N-(2-nitrophenyl)-3-[3-[(2-nitrophenyl)amino]-3-oxidanylidene-propyl]sulfanyl-propanamide

Systemtic Name: N-(2-nitrophenyl)-3-[3-[(2-nitrophenyl)amino]-3-oxidanylidene-propyl]sulfanyl-propanamide Openeye Name: 3-[3-(2-nitroanilino)-3-oxo-propyl]sulfanyl-N-(2-nitrophenyl)propanamide CAS Name: 3-[[3-(2-nitroanilino)-3-oxopropyl]thio]-N-(2-nitrophenyl)propanamide IUPAC Name: 3-[3-(2-nitroanilino)-3-oxopropyl]sulfanyl-N-(2-nitrophenyl)propanamide Traditional Name: 3-[[3-keto-3-(2-nitroanilino)propyl]thio]-N-(2-nitrophenyl)propionamide Formula: C18H18N4O6S MolecularWeight: 418.42372

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)NC(=O)CCSCCC(=O)NC2=CC=CC=C2[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)NC(=O)CCSCCC(=O)NC2=CC=CC=C2[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C18H18N4O6S/c23-17(19-13-5-1-3-7-15(13)21(25)26)9-11-29-12-10-18(24)20-14-6-2-4-8-16(14)22(27)28/h1-8H,9-12H2,(H,19,23)(H,20,24)