2-nitro-N-[(2-pyrrolidin-1-ylphenyl)carbamothioyl]benzamide

Systemtic Name: 2-nitro-N-[(2-pyrrolidin-1-ylphenyl)carbamothioyl]benzamide Openeye Name: 2-nitro-N-[(2-pyrrolidin-1-ylphenyl)carbamothioyl]benzamide CAS Name: 2-nitro-N-[[2-(1-pyrrolidinyl)anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 2-nitro-N-[(2-pyrrolidin-1-ylphenyl)carbamothioyl]benzamide Traditional Name: 2-nitro-N-[(2-pyrrolidinophenyl)thiocarbamoyl]benzamide Formula: C18H18N4O3S MolecularWeight: 370.42552

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=CC=CC=C2NC(=S)NC(=O)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)C2=CC=CC=C2NC(=S)NC(=O)C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C18H18N4O3S/c23-17(13-7-1-3-9-15(13)22(24)25)20-18(26)19-14-8-2-4-10-16(14)21-11-5-6-12-21/h1-4,7-10H,5-6,11-12H2,(H2,19,20,23,26)