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

Systemtic Name: N-tert-butyl-4-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)piperidine-1-carbothioamide Openeye Name: N-tert-butyl-4-(2,3-dihydro-1,4-benzodioxine-6-carbonyl)piperidine-1-carbothioamide CAS Name: N-tert-butyl-4-[2,3-dihydro-1,4-benzodioxin-6-yl(oxo)methyl]-1-piperidinecarbothioamide IUPAC Name: N-tert-butyl-4-(2,3-dihydro-1,4-benzodioxine-6-carbonyl)piperidine-1-carbothioamide Traditional Name: N-tert-butyl-4-(2,3-dihydro-1,4-benzodioxin-6-carbonyl)piperidine-1-carbothioamide Formula: C19H26N2O3S MolecularWeight: 362.48634

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=S)N1CCC(CC1)C(=O)C2=CC3=C(C=C2)OCCO3

Isomeric SMILES

CC(C)(C)NC(=S)N1CCC(CC1)C(=O)C2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C19H26N2O3S/c1-19(2,3)20-18(25)21-8-6-13(7-9-21)17(22)14-4-5-15-16(12-14)24-11-10-23-15/h4-5,12-13H,6-11H2,1-3H3,(H,20,25)