3,5-dinitro-N-[(2-piperidin-1-ylphenyl)carbamothioyl]benzamide

Systemtic Name: 3,5-dinitro-N-[(2-piperidin-1-ylphenyl)carbamothioyl]benzamide Openeye Name: 3,5-dinitro-N-[[2-(1-piperidyl)phenyl]carbamothioyl]benzamide CAS Name: 3,5-dinitro-N-[[2-(1-piperidinyl)anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 3,5-dinitro-N-[(2-piperidin-1-ylphenyl)carbamothioyl]benzamide Traditional Name: 3,5-dinitro-N-[(2-piperidinophenyl)thiocarbamoyl]benzamide Formula: C19H19N5O5S MolecularWeight: 429.44966

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=CC=CC=C2NC(=S)NC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)C2=CC=CC=C2NC(=S)NC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C19H19N5O5S/c25-18(13-10-14(23(26)27)12-15(11-13)24(28)29)21-19(30)20-16-6-2-3-7-17(16)22-8-4-1-5-9-22/h2-3,6-7,10-12H,1,4-5,8-9H2,(H2,20,21,25,30)