N-(3,5-dimethylphenyl)-4-(4-nitrophenyl)piperazine-1-carbothioamide

Systemtic Name: N-(3,5-dimethylphenyl)-4-(4-nitrophenyl)piperazine-1-carbothioamide Openeye Name: N-(3,5-dimethylphenyl)-4-(4-nitrophenyl)piperazine-1-carbothioamide CAS Name: N-(3,5-dimethylphenyl)-4-(4-nitrophenyl)-1-piperazinecarbothioamide IUPAC Name: N-(3,5-dimethylphenyl)-4-(4-nitrophenyl)piperazine-1-carbothioamide Traditional Name: N-(3,5-dimethylphenyl)-4-(4-nitrophenyl)piperazine-1-carbothioamide Formula: C19H22N4O2S MolecularWeight: 370.46858

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC(=S)N2CCN(CC2)C3=CC=C(C=C3)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=CC(=C1)NC(=S)N2CCN(CC2)C3=CC=C(C=C3)[N+](=O)[O-])C

InChI

InChI=1S/C19H22N4O2S/c1-14-11-15(2)13-16(12-14)20-19(26)22-9-7-21(8-10-22)17-3-5-18(6-4-17)23(24)25/h3-6,11-13H,7-10H2,1-2H3,(H,20,26)