3-(3-methylbutoxy)-N-(4-phenylpiperazin-1-yl)carbothioyl-benzamide

Systemtic Name: 3-(3-methylbutoxy)-N-(4-phenylpiperazin-1-yl)carbothioyl-benzamide Openeye Name: 3-isopentyloxy-N-(4-phenylpiperazine-1-carbothioyl)benzamide CAS Name: 3-(3-methylbutoxy)-N-[(4-phenyl-1-piperazinyl)-sulfanylidenemethyl]benzamide IUPAC Name: 3-(3-methylbutoxy)-N-(4-phenylpiperazine-1-carbothioyl)benzamide Traditional Name: 3-isoamoxy-N-(4-phenylpiperazine-1-carbothioyl)benzamide Formula: C23H29N3O2S MolecularWeight: 411.56026

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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