4-(methylamino)-3-nitro-N-[(2-pyrrol-1-ylthiophen-3-yl)methyl]benzamide

Systemtic Name: 4-(methylamino)-3-nitro-N-[(2-pyrrol-1-ylthiophen-3-yl)methyl]benzamide Openeye Name: 4-(methylamino)-3-nitro-N-[(2-pyrrol-1-yl-3-thienyl)methyl]benzamide CAS Name: 4-(methylamino)-3-nitro-N-[[2-(1-pyrrolyl)-3-thiophenyl]methyl]benzamide IUPAC Name: 4-(methylamino)-3-nitro-N-[(2-pyrrol-1-ylthiophen-3-yl)methyl]benzamide Traditional Name: 4-(methylamino)-3-nitro-N-[(2-pyrrol-1-yl-3-thienyl)methyl]benzamide Formula: C17H16N4O3S MolecularWeight: 356.39894

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=C(C=C(C=C1)C(=O)NCC2=C(SC=C2)N3C=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CNC1=C(C=C(C=C1)C(=O)NCC2=C(SC=C2)N3C=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H16N4O3S/c1-18-14-5-4-12(10-15(14)21(23)24)16(22)19-11-13-6-9-25-17(13)20-7-2-3-8-20/h2-10,18H,11H2,1H3,(H,19,22)