3-(2-methylpropoxy)-N-[4-(phenylmethyl)piperazin-1-yl]carbothioyl-benzamide

Systemtic Name: 3-(2-methylpropoxy)-N-[4-(phenylmethyl)piperazin-1-yl]carbothioyl-benzamide Openeye Name: N-(4-benzylpiperazine-1-carbothioyl)-3-isobutoxy-benzamide CAS Name: 3-(2-methylpropoxy)-N-[[4-(phenylmethyl)-1-piperazinyl]-sulfanylidenemethyl]benzamide IUPAC Name: N-(4-benzylpiperazine-1-carbothioyl)-3-(2-methylpropoxy)benzamide Traditional Name: N-(4-benzylpiperazine-1-carbothioyl)-3-isobutoxy-benzamide Formula: C23H29N3O2S MolecularWeight: 411.56026

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=CC=CC(=C1)C(=O)NC(=S)N2CCN(CC2)CC3=CC=CC=C3

Isomeric SMILES

CC(C)COC1=CC=CC(=C1)C(=O)NC(=S)N2CCN(CC2)CC3=CC=CC=C3

InChI

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