3-[(4-nitrophenyl)methyl]-5-(2-phenylsulfanylethanoyl)-6,7-dihydro-4H-imidazo[4,5-c]pyridine-6-carboxamide

Systemtic Name: 3-[(4-nitrophenyl)methyl]-5-(2-phenylsulfanylethanoyl)-6,7-dihydro-4H-imidazo[4,5-c]pyridine-6-carboxamide Openeye Name: 3-[(4-nitrophenyl)methyl]-5-(2-phenylsulfanylacetyl)-6,7-dihydro-4H-imidazo[4,5-c]pyridine-6-carboxamide CAS Name: 3-[(4-nitrophenyl)methyl]-5-[1-oxo-2-(phenylthio)ethyl]-6,7-dihydro-4H-imidazo[4,5-c]pyridine-6-carboxamide IUPAC Name: 3-[(4-nitrophenyl)methyl]-5-(2-phenylsulfanylacetyl)-6,7-dihydro-4H-imidazo[4,5-c]pyridine-6-carboxamide Traditional Name: 3-(4-nitrobenzyl)-5-[2-(phenylthio)acetyl]-6,7-dihydro-4H-imidazo[4,5-c]pyridine-6-carboxamide Formula: C22H21N5O4S MolecularWeight: 451.49824

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(CC2=C1N=CN2CC3=CC=C(C=C3)[N+](=O)[O-])C(=O)CSC4=CC=CC=C4)C(=O)N

Isomeric SMILES

C1C(N(CC2=C1N=CN2CC3=CC=C(C=C3)[N+](=O)[O-])C(=O)CSC4=CC=CC=C4)C(=O)N

InChI

InChI=1S/C22H21N5O4S/c23-22(29)19-10-18-20(12-26(19)21(28)13-32-17-4-2-1-3-5-17)25(14-24-18)11-15-6-8-16(9-7-15)27(30)31/h1-9,14,19H,10-13H2,(H2,23,29)