N-[3-[2-[(4-nitrophenyl)amino]-2-oxidanylidene-ethyl]sulfanylphenyl]cyclopropanecarboxamide

Systemtic Name: N-[3-[2-[(4-nitrophenyl)amino]-2-oxidanylidene-ethyl]sulfanylphenyl]cyclopropanecarboxamide Openeye Name: N-[3-[2-(4-nitroanilino)-2-oxo-ethyl]sulfanylphenyl]cyclopropanecarboxamide CAS Name: N-[3-[[2-(4-nitroanilino)-2-oxoethyl]thio]phenyl]cyclopropanecarboxamide IUPAC Name: N-[3-[2-(4-nitroanilino)-2-oxoethyl]sulfanylphenyl]cyclopropanecarboxamide Traditional Name: N-[3-[[2-keto-2-(4-nitroanilino)ethyl]thio]phenyl]cyclopropanecarboxamide Formula: C18H17N3O4S MolecularWeight: 371.41028

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(=O)NC2=CC(=CC=C2)SCC(=O)NC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1CC1C(=O)NC2=CC(=CC=C2)SCC(=O)NC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H17N3O4S/c22-17(19-13-6-8-15(9-7-13)21(24)25)11-26-16-3-1-2-14(10-16)20-18(23)12-4-5-12/h1-3,6-10,12H,4-5,11H2,(H,19,22)(H,20,23)