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

Systemtic Name: N-(4-butylphenyl)-4-(2,3-dimethylphenyl)piperazine-1-carbothioamide Openeye Name: N-(4-butylphenyl)-4-(2,3-dimethylphenyl)piperazine-1-carbothioamide CAS Name: N-(4-butylphenyl)-4-(2,3-dimethylphenyl)-1-piperazinecarbothioamide IUPAC Name: N-(4-butylphenyl)-4-(2,3-dimethylphenyl)piperazine-1-carbothioamide Traditional Name: N-(4-butylphenyl)-4-(2,3-dimethylphenyl)piperazine-1-carbothioamide Formula: C23H31N3S MolecularWeight: 381.57734

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=S)N2CCN(CC2)C3=CC=CC(=C3C)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=S)N2CCN(CC2)C3=CC=CC(=C3C)C

InChI

InChI=1S/C23H31N3S/c1-4-5-8-20-10-12-21(13-11-20)24-23(27)26-16-14-25(15-17-26)22-9-6-7-18(2)19(22)3/h6-7,9-13H,4-5,8,14-17H2,1-3H3,(H,24,27)