N-(4-tert-butylphenyl)-4-phenyl-piperazine-1-carbothioamide

Systemtic Name: N-(4-tert-butylphenyl)-4-phenyl-piperazine-1-carbothioamide Openeye Name: N-(4-tert-butylphenyl)-4-phenyl-piperazine-1-carbothioamide CAS Name: N-(4-tert-butylphenyl)-4-phenyl-1-piperazinecarbothioamide IUPAC Name: N-(4-tert-butylphenyl)-4-phenylpiperazine-1-carbothioamide Traditional Name: N-(4-tert-butylphenyl)-4-phenyl-piperazine-1-carbothioamide Formula: C21H27N3S MolecularWeight: 353.52418

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H27N3S/c1-21(2,3)17-9-11-18(12-10-17)22-20(25)24-15-13-23(14-16-24)19-7-5-4-6-8-19/h4-12H,13-16H2,1-3H3,(H,22,25)