2-[(6-chloranyl-1H-benzimidazol-2-yl)sulfanyl]-N-[(3,4-dimethoxyphenyl)methyl]propanamide

Systemtic Name: 2-[(6-chloranyl-1H-benzimidazol-2-yl)sulfanyl]-N-[(3,4-dimethoxyphenyl)methyl]propanamide Openeye Name: 2-[(6-chloro-1H-benzimidazol-2-yl)sulfanyl]-N-[(3,4-dimethoxyphenyl)methyl]propanamide CAS Name: 2-[(6-chloro-1H-benzimidazol-2-yl)thio]-N-[(3,4-dimethoxyphenyl)methyl]propanamide IUPAC Name: 2-[(6-chloro-1H-benzimidazol-2-yl)sulfanyl]-N-[(3,4-dimethoxyphenyl)methyl]propanamide Traditional Name: 2-[(6-chloro-1H-benzimidazol-2-yl)thio]-N-veratryl-propionamide Formula: C19H20ClN3O3S MolecularWeight: 405.8984

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC(=C(C=C1)OC)OC)SC2=NC3=C(N2)C=C(C=C3)Cl

Isomeric SMILES

CC(C(=O)NCC1=CC(=C(C=C1)OC)OC)SC2=NC3=C(N2)C=C(C=C3)Cl

InChI

InChI=1S/C19H20ClN3O3S/c1-11(27-19-22-14-6-5-13(20)9-15(14)23-19)18(24)21-10-12-4-7-16(25-2)17(8-12)26-3/h4-9,11H,10H2,1-3H3,(H,21,24)(H,22,23)