N-(1,3-benzodioxol-5-yl)-4-(1-methylsulfonylpiperidin-4-yl)piperidine-1-carbothioamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-4-(1-methylsulfonylpiperidin-4-yl)piperidine-1-carbothioamide Openeye Name: N-(1,3-benzodioxol-5-yl)-4-(1-methylsulfonyl-4-piperidyl)piperidine-1-carbothioamide CAS Name: N-(1,3-benzodioxol-5-yl)-4-(1-methylsulfonyl-4-piperidinyl)-1-piperidinecarbothioamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-4-(1-methylsulfonylpiperidin-4-yl)piperidine-1-carbothioamide Traditional Name: N-(1,3-benzodioxol-5-yl)-4-(1-mesyl-4-piperidyl)piperidine-1-carbothioamide Formula: C19H27N3O4S2 MolecularWeight: 425.56538

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCC(CC1)C2CCN(CC2)C(=S)NC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CS(=O)(=O)N1CCC(CC1)C2CCN(CC2)C(=S)NC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C19H27N3O4S2/c1-28(23,24)22-10-6-15(7-11-22)14-4-8-21(9-5-14)19(27)20-16-2-3-17-18(12-16)26-13-25-17/h2-3,12,14-15H,4-11,13H2,1H3,(H,20,27)