2-(2-methylpropoxy)-N-[4-(phenylmethyl)piperazin-1-yl]carbothioyl-benzamide

Systemtic Name: 2-(2-methylpropoxy)-N-[4-(phenylmethyl)piperazin-1-yl]carbothioyl-benzamide Openeye Name: N-(4-benzylpiperazine-1-carbothioyl)-2-isobutoxy-benzamide CAS Name: 2-(2-methylpropoxy)-N-[[4-(phenylmethyl)-1-piperazinyl]-sulfanylidenemethyl]benzamide IUPAC Name: N-(4-benzylpiperazine-1-carbothioyl)-2-(2-methylpropoxy)benzamide Traditional Name: N-(4-benzylpiperazine-1-carbothioyl)-2-isobutoxy-benzamide Formula: C23H29N3O2S MolecularWeight: 411.56026

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=CC=CC=C1C(=O)NC(=S)N2CCN(CC2)CC3=CC=CC=C3

Isomeric SMILES

CC(C)COC1=CC=CC=C1C(=O)NC(=S)N2CCN(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C23H29N3O2S/c1-18(2)17-28-21-11-7-6-10-20(21)22(27)24-23(29)26-14-12-25(13-15-26)16-19-8-4-3-5-9-19/h3-11,18H,12-17H2,1-2H3,(H,24,27,29)