N-(4-butan-2-ylphenyl)-4-(phenylmethyl)piperazine-1-carbothioamide

Systemtic Name: N-(4-butan-2-ylphenyl)-4-(phenylmethyl)piperazine-1-carbothioamide Openeye Name: 4-benzyl-N-(4-sec-butylphenyl)piperazine-1-carbothioamide CAS Name: N-(4-butan-2-ylphenyl)-4-(phenylmethyl)-1-piperazinecarbothioamide IUPAC Name: 4-benzyl-N-(4-butan-2-ylphenyl)piperazine-1-carbothioamide Traditional Name: 4-benzyl-N-(4-sec-butylphenyl)piperazine-1-carbothioamide Formula: C22H29N3S MolecularWeight: 367.55076

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)NC(=S)N2CCN(CC2)CC3=CC=CC=C3

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)NC(=S)N2CCN(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C22H29N3S/c1-3-18(2)20-9-11-21(12-10-20)23-22(26)25-15-13-24(14-16-25)17-19-7-5-4-6-8-19/h4-12,18H,3,13-17H2,1-2H3,(H,23,26)