N-[(E)-(2-nitrophenyl)methylideneamino]-2-(phenylmethylsulfanyl)propanamide

Systemtic Name: N-[(E)-(2-nitrophenyl)methylideneamino]-2-(phenylmethylsulfanyl)propanamide Openeye Name: 2-benzylsulfanyl-N-[(E)-(2-nitrophenyl)methyleneamino]propanamide CAS Name: N-[(E)-(2-nitrophenyl)methylideneamino]-2-(phenylmethylthio)propanamide IUPAC Name: 2-benzylsulfanyl-N-[(E)-(2-nitrophenyl)methylideneamino]propanamide Traditional Name: 2-(benzylthio)-N-[(E)-(2-nitrobenzylidene)amino]propionamide Formula: C17H17N3O3S MolecularWeight: 343.40018

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NN=CC1=CC=CC=C1[N+](=O)[O-])SCC2=CC=CC=C2

Isomeric SMILES

CC(C(=O)N/N=C/C1=CC=CC=C1[N+](=O)[O-])SCC2=CC=CC=C2

InChI

InChI=1S/C17H17N3O3S/c1-13(24-12-14-7-3-2-4-8-14)17(21)19-18-11-15-9-5-6-10-16(15)20(22)23/h2-11,13H,12H2,1H3,(H,19,21)/b18-11+