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

Systemtic Name: 4-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)-N-(3-propan-2-yloxypropyl)piperidine-1-carbothioamide Openeye Name: 4-(2,3-dihydro-1,4-benzodioxine-6-carbonyl)-N-(3-isopropoxypropyl)piperidine-1-carbothioamide CAS Name: 4-[2,3-dihydro-1,4-benzodioxin-6-yl(oxo)methyl]-N-(3-propan-2-yloxypropyl)-1-piperidinecarbothioamide IUPAC Name: 4-(2,3-dihydro-1,4-benzodioxine-6-carbonyl)-N-(3-propan-2-yloxypropyl)piperidine-1-carbothioamide Traditional Name: 4-(2,3-dihydro-1,4-benzodioxin-6-carbonyl)-N-(3-isopropoxypropyl)piperidine-1-carbothioamide Formula: C21H30N2O4S MolecularWeight: 406.5389

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H30N2O4S/c1-15(2)25-11-3-8-22-21(28)23-9-6-16(7-10-23)20(24)17-4-5-18-19(14-17)27-13-12-26-18/h4-5,14-16H,3,6-13H2,1-2H3,(H,22,28)