N-(3-ethoxypropyl)-4-[(2-methylphenyl)methyl]piperazine-1-carbothioamide

Systemtic Name: N-(3-ethoxypropyl)-4-[(2-methylphenyl)methyl]piperazine-1-carbothioamide Openeye Name: N-(3-ethoxypropyl)-4-(o-tolylmethyl)piperazine-1-carbothioamide CAS Name: N-(3-ethoxypropyl)-4-[(2-methylphenyl)methyl]-1-piperazinecarbothioamide IUPAC Name: N-(3-ethoxypropyl)-4-[(2-methylphenyl)methyl]piperazine-1-carbothioamide Traditional Name: N-(3-ethoxypropyl)-4-(2-methylbenzyl)piperazine-1-carbothioamide Formula: C18H29N3OS MolecularWeight: 335.50736

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCCNC(=S)N1CCN(CC1)CC2=CC=CC=C2C

Isomeric SMILES

CCOCCCNC(=S)N1CCN(CC1)CC2=CC=CC=C2C

InChI

InChI=1S/C18H29N3OS/c1-3-22-14-6-9-19-18(23)21-12-10-20(11-13-21)15-17-8-5-4-7-16(17)2/h4-5,7-8H,3,6,9-15H2,1-2H3,(H,19,23)