N-(4-chloranyl-2-nitro-phenyl)-2-(1-ethylbenzimidazol-2-yl)sulfanyl-propanamide

Systemtic Name: N-(4-chloranyl-2-nitro-phenyl)-2-(1-ethylbenzimidazol-2-yl)sulfanyl-propanamide Openeye Name: N-(4-chloro-2-nitro-phenyl)-2-(1-ethylbenzimidazol-2-yl)sulfanyl-propanamide CAS Name: N-(4-chloro-2-nitrophenyl)-2-[(1-ethyl-2-benzimidazolyl)thio]propanamide IUPAC Name: N-(4-chloro-2-nitrophenyl)-2-(1-ethylbenzimidazol-2-yl)sulfanylpropanamide Traditional Name: N-(4-chloro-2-nitro-phenyl)-2-[(1-ethylbenzimidazol-2-yl)thio]propionamide Formula: C18H17ClN4O3S MolecularWeight: 404.87058

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2N=C1SC(C)C(=O)NC3=C(C=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

CCN1C2=CC=CC=C2N=C1SC(C)C(=O)NC3=C(C=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C18H17ClN4O3S/c1-3-22-15-7-5-4-6-13(15)21-18(22)27-11(2)17(24)20-14-9-8-12(19)10-16(14)23(25)26/h4-11H,3H2,1-2H3,(H,20,24)