N-butyl-4-[(3-methoxyphenyl)methyl]piperazine-1-carbothioamide

Systemtic Name: N-butyl-4-[(3-methoxyphenyl)methyl]piperazine-1-carbothioamide Openeye Name: N-butyl-4-[(3-methoxyphenyl)methyl]piperazine-1-carbothioamide CAS Name: N-butyl-4-[(3-methoxyphenyl)methyl]-1-piperazinecarbothioamide IUPAC Name: N-butyl-4-[(3-methoxyphenyl)methyl]piperazine-1-carbothioamide Traditional Name: N-butyl-4-m-anisyl-piperazine-1-carbothioamide Formula: C17H27N3OS MolecularWeight: 321.48078

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=S)N1CCN(CC1)CC2=CC(=CC=C2)OC

Isomeric SMILES

CCCCNC(=S)N1CCN(CC1)CC2=CC(=CC=C2)OC

InChI

InChI=1S/C17H27N3OS/c1-3-4-8-18-17(22)20-11-9-19(10-12-20)14-15-6-5-7-16(13-15)21-2/h5-7,13H,3-4,8-12,14H2,1-2H3,(H,18,22)