methyl 2-[(2-aminophenyl)methylsulfanyl]-6-methoxy-3H-benzimidazole-5-carboxylate

Systemtic Name: methyl 2-[(2-aminophenyl)methylsulfanyl]-6-methoxy-3H-benzimidazole-5-carboxylate Openeye Name: methyl 2-[(2-aminophenyl)methylsulfanyl]-6-methoxy-3H-benzimidazole-5-carboxylate CAS Name: 2-[(2-aminophenyl)methylthio]-6-methoxy-3H-benzimidazole-5-carboxylic acid methyl ester IUPAC Name: methyl 2-[(2-aminophenyl)methylsulfanyl]-6-methoxy-3H-benzimidazole-5-carboxylate Traditional Name: 2-[(2-aminobenzyl)thio]-6-methoxy-3H-benzimidazole-5-carboxylic acid methyl ester Formula: C17H17N3O3S MolecularWeight: 343.40018

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1C(=O)OC)NC(=N2)SCC3=CC=CC=C3N

Isomeric SMILES

COC1=CC2=C(C=C1C(=O)OC)NC(=N2)SCC3=CC=CC=C3N

InChI

InChI=1S/C17H17N3O3S/c1-22-15-8-14-13(7-11(15)16(21)23-2)19-17(20-14)24-9-10-5-3-4-6-12(10)18/h3-8H,9,18H2,1-2H3,(H,19,20)