4-(methylamino)-3-nitro-N-(2-prop-2-enylsulfanylphenyl)benzamide

Systemtic Name: 4-(methylamino)-3-nitro-N-(2-prop-2-enylsulfanylphenyl)benzamide Openeye Name: N-(2-allylsulfanylphenyl)-4-(methylamino)-3-nitro-benzamide CAS Name: 4-(methylamino)-3-nitro-N-[2-(prop-2-enylthio)phenyl]benzamide IUPAC Name: 4-(methylamino)-3-nitro-N-(2-prop-2-enylsulfanylphenyl)benzamide Traditional Name: N-[2-(allylthio)phenyl]-4-(methylamino)-3-nitro-benzamide Formula: C17H17N3O3S MolecularWeight: 343.40018

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=C(C=C(C=C1)C(=O)NC2=CC=CC=C2SCC=C)[N+](=O)[O-]

Isomeric SMILES

CNC1=C(C=C(C=C1)C(=O)NC2=CC=CC=C2SCC=C)[N+](=O)[O-]

InChI

InChI=1S/C17H17N3O3S/c1-3-10-24-16-7-5-4-6-14(16)19-17(21)12-8-9-13(18-2)15(11-12)20(22)23/h3-9,11,18H,1,10H2,2H3,(H,19,21)