S-[[5-(1H-benzimidazol-2-yl)-2-chloranyl-phenyl]carbamoylamino] 2,6-dimethoxybenzenecarbothioate

Systemtic Name: S-[[5-(1H-benzimidazol-2-yl)-2-chloranyl-phenyl]carbamoylamino] 2,6-dimethoxybenzenecarbothioate Openeye Name: S-[[5-(1H-benzimidazol-2-yl)-2-chloro-phenyl]carbamoylamino] 2,6-dimethoxybenzenecarbothioate CAS Name: 2,6-dimethoxybenzenecarbothioic acid S-[[[5-(1H-benzimidazol-2-yl)-2-chloroanilino]-oxomethyl]amino] ester IUPAC Name: S-[[5-(1H-benzimidazol-2-yl)-2-chlorophenyl]carbamoylamino] 2,6-dimethoxybenzenecarbothioate Traditional Name: 2,6-dimethoxythiobenzoic acid S-[[5-(1H-benzimidazol-2-yl)-2-chloro-phenyl]carbamoylamino] ester Formula: C23H19ClN4O4S MolecularWeight: 482.93936

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC=C1)OC)C(=O)SNC(=O)NC2=C(C=CC(=C2)C3=NC4=CC=CC=C4N3)Cl

Isomeric SMILES

COC1=C(C(=CC=C1)OC)C(=O)SNC(=O)NC2=C(C=CC(=C2)C3=NC4=CC=CC=C4N3)Cl

InChI

InChI=1S/C23H19ClN4O4S/c1-31-18-8-5-9-19(32-2)20(18)22(29)33-28-23(30)27-17-12-13(10-11-14(17)24)21-25-15-6-3-4-7-16(15)26-21/h3-12H,1-2H3,(H,25,26)(H2,27,28,30)