N-[2-[(2-nitrophenyl)amino]ethyl]-2-phenylsulfanyl-pyridine-3-carboxamide

Systemtic Name: N-[2-[(2-nitrophenyl)amino]ethyl]-2-phenylsulfanyl-pyridine-3-carboxamide Openeye Name: N-[2-(2-nitroanilino)ethyl]-2-phenylsulfanyl-pyridine-3-carboxamide CAS Name: N-[2-(2-nitroanilino)ethyl]-2-(phenylthio)-3-pyridinecarboxamide IUPAC Name: N-[2-(2-nitroanilino)ethyl]-2-phenylsulfanylpyridine-3-carboxamide Traditional Name: N-[2-(2-nitroanilino)ethyl]-2-(phenylthio)nicotinamide Formula: C20H18N4O3S MolecularWeight: 394.44692

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SC2=C(C=CC=N2)C(=O)NCCNC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)SC2=C(C=CC=N2)C(=O)NCCNC3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C20H18N4O3S/c25-19(22-14-13-21-17-10-4-5-11-18(17)24(26)27)16-9-6-12-23-20(16)28-15-7-2-1-3-8-15/h1-12,21H,13-14H2,(H,22,25)