N-(2,3-dimethylphenyl)-4-[methyl(oxolan-2-ylmethyl)amino]piperidine-1-carbothioamide

Systemtic Name: N-(2,3-dimethylphenyl)-4-[methyl(oxolan-2-ylmethyl)amino]piperidine-1-carbothioamide Openeye Name: N-(2,3-dimethylphenyl)-4-[methyl(tetrahydrofuran-2-ylmethyl)amino]piperidine-1-carbothioamide CAS Name: N-(2,3-dimethylphenyl)-4-[methyl(2-oxolanylmethyl)amino]-1-piperidinecarbothioamide IUPAC Name: N-(2,3-dimethylphenyl)-4-[methyl(oxolan-2-ylmethyl)amino]piperidine-1-carbothioamide Traditional Name: N-(2,3-dimethylphenyl)-4-[methyl(tetrahydrofurfuryl)amino]piperidine-1-carbothioamide Formula: C20H31N3OS MolecularWeight: 361.54464

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NC(=S)N2CCC(CC2)N(C)CC3CCCO3)C

Isomeric SMILES

CC1=C(C(=CC=C1)NC(=S)N2CCC(CC2)N(C)CC3CCCO3)C

InChI

InChI=1S/C20H31N3OS/c1-15-6-4-8-19(16(15)2)21-20(25)23-11-9-17(10-12-23)22(3)14-18-7-5-13-24-18/h4,6,8,17-18H,5,7,9-14H2,1-3H3,(H,21,25)