N-cyclohexyl-4-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)piperidine-1-carbothioamide

Systemtic Name: N-cyclohexyl-4-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)piperidine-1-carbothioamide Openeye Name: N-cyclohexyl-4-(2,3-dihydro-1,4-benzodioxine-6-carbonyl)piperidine-1-carbothioamide CAS Name: N-cyclohexyl-4-[2,3-dihydro-1,4-benzodioxin-6-yl(oxo)methyl]-1-piperidinecarbothioamide IUPAC Name: N-cyclohexyl-4-(2,3-dihydro-1,4-benzodioxine-6-carbonyl)piperidine-1-carbothioamide Traditional Name: N-cyclohexyl-4-(2,3-dihydro-1,4-benzodioxin-6-carbonyl)piperidine-1-carbothioamide Formula: C21H28N2O3S MolecularWeight: 388.52362

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=S)N2CCC(CC2)C(=O)C3=CC4=C(C=C3)OCCO4

Isomeric SMILES

C1CCC(CC1)NC(=S)N2CCC(CC2)C(=O)C3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C21H28N2O3S/c24-20(16-6-7-18-19(14-16)26-13-12-25-18)15-8-10-23(11-9-15)21(27)22-17-4-2-1-3-5-17/h6-7,14-15,17H,1-5,8-13H2,(H,22,27)