3-[1-(2-methoxyethyl)benzimidazol-2-yl]sulfanyl-N-(2-methoxy-4-nitro-phenyl)propanamide

Systemtic Name: 3-[1-(2-methoxyethyl)benzimidazol-2-yl]sulfanyl-N-(2-methoxy-4-nitro-phenyl)propanamide Openeye Name: 3-[1-(2-methoxyethyl)benzimidazol-2-yl]sulfanyl-N-(2-methoxy-4-nitro-phenyl)propanamide CAS Name: 3-[[1-(2-methoxyethyl)-2-benzimidazolyl]thio]-N-(2-methoxy-4-nitrophenyl)propanamide IUPAC Name: 3-[1-(2-methoxyethyl)benzimidazol-2-yl]sulfanyl-N-(2-methoxy-4-nitrophenyl)propanamide Traditional Name: 3-[[1-(2-methoxyethyl)benzimidazol-2-yl]thio]-N-(2-methoxy-4-nitro-phenyl)propionamide Formula: C20H22N4O5S MolecularWeight: 430.47748

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Descriptors Computed from Structure

Canonical SMILES:

COCCN1C2=CC=CC=C2N=C1SCCC(=O)NC3=C(C=C(C=C3)[N+](=O)[O-])OC

Isomeric SMILES

COCCN1C2=CC=CC=C2N=C1SCCC(=O)NC3=C(C=C(C=C3)[N+](=O)[O-])OC

InChI

InChI=1S/C20H22N4O5S/c1-28-11-10-23-17-6-4-3-5-15(17)22-20(23)30-12-9-19(25)21-16-8-7-14(24(26)27)13-18(16)29-2/h3-8,13H,9-12H2,1-2H3,(H,21,25)