3-nitro-N-[(2-phenylphenyl)carbamothioyl]-4-piperidin-1-yl-benzamide

Systemtic Name: 3-nitro-N-[(2-phenylphenyl)carbamothioyl]-4-piperidin-1-yl-benzamide Openeye Name: 3-nitro-N-[(2-phenylphenyl)carbamothioyl]-4-(1-piperidyl)benzamide CAS Name: 3-nitro-N-[(2-phenylanilino)-sulfanylidenemethyl]-4-(1-piperidinyl)benzamide IUPAC Name: 3-nitro-N-[(2-phenylphenyl)carbamothioyl]-4-piperidin-1-ylbenzamide Traditional Name: 3-nitro-N-[(2-phenylphenyl)thiocarbamoyl]-4-piperidino-benzamide Formula: C25H24N4O3S MolecularWeight: 460.54806

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C=C(C=C2)C(=O)NC(=S)NC3=CC=CC=C3C4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)C2=C(C=C(C=C2)C(=O)NC(=S)NC3=CC=CC=C3C4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C25H24N4O3S/c30-24(19-13-14-22(23(17-19)29(31)32)28-15-7-2-8-16-28)27-25(33)26-21-12-6-5-11-20(21)18-9-3-1-4-10-18/h1,3-6,9-14,17H,2,7-8,15-16H2,(H2,26,27,30,33)