N-(3-ethylphenyl)-4-(4-nitrophenyl)piperazine-1-carbothioamide

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC=C1)NC(=S)N2CCN(CC2)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCC1=CC(=CC=C1)NC(=S)N2CCN(CC2)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

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