4-(1,3-benzodioxol-5-yloxy)-N-(3,5-dimethylphenyl)piperidine-1-carbothioamide

Systemtic Name: 4-(1,3-benzodioxol-5-yloxy)-N-(3,5-dimethylphenyl)piperidine-1-carbothioamide Openeye Name: 4-(1,3-benzodioxol-5-yloxy)-N-(3,5-dimethylphenyl)piperidine-1-carbothioamide CAS Name: 4-(1,3-benzodioxol-5-yloxy)-N-(3,5-dimethylphenyl)-1-piperidinecarbothioamide IUPAC Name: 4-(1,3-benzodioxol-5-yloxy)-N-(3,5-dimethylphenyl)piperidine-1-carbothioamide Traditional Name: 4-(1,3-benzodioxol-5-yloxy)-N-(3,5-dimethylphenyl)piperidine-1-carbothioamide Formula: C21H24N2O3S MolecularWeight: 384.49186

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC(=S)N2CCC(CC2)OC3=CC4=C(C=C3)OCO4)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC(=S)N2CCC(CC2)OC3=CC4=C(C=C3)OCO4)C

InChI

InChI=1S/C21H24N2O3S/c1-14-9-15(2)11-16(10-14)22-21(27)23-7-5-17(6-8-23)26-18-3-4-19-20(12-18)25-13-24-19/h3-4,9-12,17H,5-8,13H2,1-2H3,(H,22,27)