N-(3-methoxyphenyl)-4-(3-methylbutyl)piperazine-1-carbothioamide

Systemtic Name: N-(3-methoxyphenyl)-4-(3-methylbutyl)piperazine-1-carbothioamide Openeye Name: 4-isopentyl-N-(3-methoxyphenyl)piperazine-1-carbothioamide CAS Name: N-(3-methoxyphenyl)-4-(3-methylbutyl)-1-piperazinecarbothioamide IUPAC Name: N-(3-methoxyphenyl)-4-(3-methylbutyl)piperazine-1-carbothioamide Traditional Name: 4-isoamyl-N-(3-methoxyphenyl)piperazine-1-carbothioamide Formula: C17H27N3OS MolecularWeight: 321.48078

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1CCN(CC1)C(=S)NC2=CC(=CC=C2)OC

Isomeric SMILES

CC(C)CCN1CCN(CC1)C(=S)NC2=CC(=CC=C2)OC

InChI

InChI=1S/C17H27N3OS/c1-14(2)7-8-19-9-11-20(12-10-19)17(22)18-15-5-4-6-16(13-15)21-3/h4-6,13-14H,7-12H2,1-3H3,(H,18,22)