4-(2,3-dimethylphenyl)-N-(2-nitrophenyl)piperazine-1-carbothioamide

Systemtic Name: 4-(2,3-dimethylphenyl)-N-(2-nitrophenyl)piperazine-1-carbothioamide Openeye Name: 4-(2,3-dimethylphenyl)-N-(2-nitrophenyl)piperazine-1-carbothioamide CAS Name: 4-(2,3-dimethylphenyl)-N-(2-nitrophenyl)-1-piperazinecarbothioamide IUPAC Name: 4-(2,3-dimethylphenyl)-N-(2-nitrophenyl)piperazine-1-carbothioamide Traditional Name: 4-(2,3-dimethylphenyl)-N-(2-nitrophenyl)piperazine-1-carbothioamide Formula: C19H22N4O2S MolecularWeight: 370.46858

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2CCN(CC2)C(=S)NC3=CC=CC=C3[N+](=O)[O-])C

Isomeric SMILES

CC1=C(C(=CC=C1)N2CCN(CC2)C(=S)NC3=CC=CC=C3[N+](=O)[O-])C

InChI

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