RInChI=1.00.1S/C11H14N2/c1-11(2,3)10-6-9(13)5-4-8(10)7-12/h4-6H,13H2,1-3H3!CCl2S/c2-1(3)4!CH2O3.Ca/c2-1(3)4;/h(H2,2,3,4);/q;+2/p-2!ClH/h1H<>C12H12N2S/c1-12(2,3)11-6-10(14-8-15)5-4-9(11)7-13/h4-6H,1-3H3<>CH2Cl2/c2-1-3/h1H2!H2O/h1H2/d+
RAuxInfo=1.00.1/0/N:1,2,3,4,5,6,7,8,9,10,11,12,13/E:(1,2,3)/rA:13CCCCCCCCCCCNN/rB:;;;d4;;;s4s7;s5d6;s6d8;s1s2s3s10;t7;s9;/rC:;;;;;;;;;;;;;!0/N:1,2,3,4/E:(2,3)/rA:4CClClS/rB:s1;s1;d1;/rC:;;;;!1/N:1,2,3,4;5/E:(2,3,4);/rA:5COO-O-Ca+2/rB:d1;s1;s1;;/rC:;;;;;!0/N:1/rA:1Cl/rB:/rC:;<>0/N:1,2,3,4,5,6,7,8,9,10,11,12,13,14,15/E:(1,2,3)/rA:15CCCCCCCCCCCCNNS/rB:;;;d4;;;;s4s7;s5d6;s6d9;s1s2s3s11;t7;d8s10;d8;/rC:;;;;;;;;;;;;;;;<>0/N:1,2,3/E:(2,3)/rA:3CClCl/rB:s1;s1;/rC:;;;!0/N:1/rA:1O/rB:/rC:;
Long-RInChIKey=SA-FUHFF-OKIGBZMPKDJISC-UHFFFAOYSA-N-ZWZVWGITAAIFPS-UHFFFAOYSA-N-VTYYLEPIZMXCLO-UHFFFAOYSA-L-VEXZGXHMUGYJMC-UHFFFAOYSA-N--AVOZHXIYFJIZGI-UHFFFAOYSA-N--YMWUJEATGCHHMB-UHFFFAOYSA-N-XLYOFNOQVPJJNP-UHFFFAOYSA-N
Short-RInChIKey=SA-FUHFF-WPADAOHWOL-AVOZHXIYFJ-LEKFFBIZBV-LUHFF-NUHFF-NUHFF-ZZZ
Web-RInChIKey=NRLTYVSUPTVPLYLIP-LUHFFFADPSCTJSA