4-(phenylmethyl)-N-(2,4,4-trimethylpentan-2-yl)piperazine-1-carbothioamide

Systemtic Name: 4-(phenylmethyl)-N-(2,4,4-trimethylpentan-2-yl)piperazine-1-carbothioamide Openeye Name: 4-benzyl-N-(1,1,3,3-tetramethylbutyl)piperazine-1-carbothioamide CAS Name: 4-(phenylmethyl)-N-(2,4,4-trimethylpentan-2-yl)-1-piperazinecarbothioamide IUPAC Name: 4-benzyl-N-(2,4,4-trimethylpentan-2-yl)piperazine-1-carbothioamide Traditional Name: 4-benzyl-N-(1,1,3,3-tetramethylbutyl)piperazine-1-carbothioamide Formula: C20H33N3S MolecularWeight: 347.56112

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(C)(C)NC(=S)N1CCN(CC1)CC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)CC(C)(C)NC(=S)N1CCN(CC1)CC2=CC=CC=C2

InChI

InChI=1S/C20H33N3S/c1-19(2,3)16-20(4,5)21-18(24)23-13-11-22(12-14-23)15-17-9-7-6-8-10-17/h6-10H,11-16H2,1-5H3,(H,21,24)