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

Systemtic Name: 4-(2,3-dihydro-1,4-benzodioxin-3-ylcarbonyl)-N-(3-propan-2-yloxypropyl)piperazine-1-carbothioamide Openeye Name: 4-(2,3-dihydro-1,4-benzodioxine-3-carbonyl)-N-(3-isopropoxypropyl)piperazine-1-carbothioamide CAS Name: 4-[2,3-dihydro-1,4-benzodioxin-3-yl(oxo)methyl]-N-(3-propan-2-yloxypropyl)-1-piperazinecarbothioamide IUPAC Name: 4-(2,3-dihydro-1,4-benzodioxine-3-carbonyl)-N-(3-propan-2-yloxypropyl)piperazine-1-carbothioamide Traditional Name: 4-(2,3-dihydro-1,4-benzodioxin-3-carbonyl)-N-(3-isopropoxypropyl)piperazine-1-carbothioamide Formula: C20H29N3O4S MolecularWeight: 407.52696

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)OCCCNC(=S)N1CCN(CC1)C(=O)C2COC3=CC=CC=C3O2

Isomeric SMILES

CC(C)OCCCNC(=S)N1CCN(CC1)C(=O)C2COC3=CC=CC=C3O2

InChI

InChI=1S/C20H29N3O4S/c1-15(2)25-13-5-8-21-20(28)23-11-9-22(10-12-23)19(24)18-14-26-16-6-3-4-7-17(16)27-18/h3-4,6-7,15,18H,5,8-14H2,1-2H3,(H,21,28)