N-[1-(2-diethylaminoethyl)benzimidazol-2-yl]-2-[(4-methoxy-3-nitro-phenyl)methylsulfanyl]ethanamide

Systemtic Name: N-[1-(2-diethylaminoethyl)benzimidazol-2-yl]-2-[(4-methoxy-3-nitro-phenyl)methylsulfanyl]ethanamide Openeye Name: N-[1-(2-diethylaminoethyl)benzimidazol-2-yl]-2-[(4-methoxy-3-nitro-phenyl)methylsulfanyl]acetamide CAS Name: N-[1-(2-diethylaminoethyl)-2-benzimidazolyl]-2-[(4-methoxy-3-nitrophenyl)methylthio]acetamide IUPAC Name: N-[1-(2-diethylaminoethyl)benzimidazol-2-yl]-2-[(4-methoxy-3-nitrophenyl)methylsulfanyl]acetamide Traditional Name: N-[1-(2-diethylaminoethyl)benzimidazol-2-yl]-2-[(4-methoxy-3-nitro-benzyl)thio]acetamide Formula: C23H29N5O4S MolecularWeight: 471.57246

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCN1C2=CC=CC=C2N=C1NC(=O)CSCC3=CC(=C(C=C3)OC)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)CCN1C2=CC=CC=C2N=C1NC(=O)CSCC3=CC(=C(C=C3)OC)[N+](=O)[O-]

InChI

InChI=1S/C23H29N5O4S/c1-4-26(5-2)12-13-27-19-9-7-6-8-18(19)24-23(27)25-22(29)16-33-15-17-10-11-21(32-3)20(14-17)28(30)31/h6-11,14H,4-5,12-13,15-16H2,1-3H3,(H,24,25,29)