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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=CC=CC(=C1)C(=O)NC(=S)N2CCN(CC2)CC3=CC=CC=C3

Isomeric SMILES

CC(C)CCOC1=CC=CC(=C1)C(=O)NC(=S)N2CCN(CC2)CC3=CC=CC=C3

InChI

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