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

Systemtic Name: 2-(3-methylbutoxy)-N-[4-(phenylmethyl)piperazin-1-yl]carbothioyl-benzamide Openeye Name: N-(4-benzylpiperazine-1-carbothioyl)-2-isopentyloxy-benzamide CAS Name: 2-(3-methylbutoxy)-N-[[4-(phenylmethyl)-1-piperazinyl]-sulfanylidenemethyl]benzamide IUPAC Name: N-(4-benzylpiperazine-1-carbothioyl)-2-(3-methylbutoxy)benzamide Traditional Name: N-(4-benzylpiperazine-1-carbothioyl)-2-isoamoxy-benzamide Formula: C24H31N3O2S MolecularWeight: 425.58684

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=CC=CC=C1C(=O)NC(=S)N2CCN(CC2)CC3=CC=CC=C3

Isomeric SMILES

CC(C)CCOC1=CC=CC=C1C(=O)NC(=S)N2CCN(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C24H31N3O2S/c1-19(2)12-17-29-22-11-7-6-10-21(22)23(28)25-24(30)27-15-13-26(14-16-27)18-20-8-4-3-5-9-20/h3-11,19H,12-18H2,1-2H3,(H,25,28,30)