2-methyl-3-nitro-N-[(4-piperidin-1-ylphenyl)carbamothioyl]benzamide

Systemtic Name: 2-methyl-3-nitro-N-[(4-piperidin-1-ylphenyl)carbamothioyl]benzamide Openeye Name: 2-methyl-3-nitro-N-[[4-(1-piperidyl)phenyl]carbamothioyl]benzamide CAS Name: 2-methyl-3-nitro-N-[[4-(1-piperidinyl)anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 2-methyl-3-nitro-N-[(4-piperidin-1-ylphenyl)carbamothioyl]benzamide Traditional Name: 2-methyl-3-nitro-N-[(4-piperidinophenyl)thiocarbamoyl]benzamide Formula: C20H22N4O3S MolecularWeight: 398.47868

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)[O-])C(=O)NC(=S)NC2=CC=C(C=C2)N3CCCCC3

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])C(=O)NC(=S)NC2=CC=C(C=C2)N3CCCCC3

InChI

InChI=1S/C20H22N4O3S/c1-14-17(6-5-7-18(14)24(26)27)19(25)22-20(28)21-15-8-10-16(11-9-15)23-12-3-2-4-13-23/h5-11H,2-4,12-13H2,1H3,(H2,21,22,25,28)