N-cyclohexyl-4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)piperazine-1-carbothioamide

Systemtic Name: N-cyclohexyl-4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)piperazine-1-carbothioamide Openeye Name: N-cyclohexyl-4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)piperazine-1-carbothioamide CAS Name: N-cyclohexyl-4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-1-piperazinecarbothioamide IUPAC Name: N-cyclohexyl-4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)piperazine-1-carbothioamide Traditional Name: N-cyclohexyl-4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)piperazine-1-carbothioamide Formula: C19H27N3O4S2 MolecularWeight: 425.56538

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=S)N2CCN(CC2)S(=O)(=O)C3=CC4=C(C=C3)OCCO4

Isomeric SMILES

C1CCC(CC1)NC(=S)N2CCN(CC2)S(=O)(=O)C3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C19H27N3O4S2/c23-28(24,16-6-7-17-18(14-16)26-13-12-25-17)22-10-8-21(9-11-22)19(27)20-15-4-2-1-3-5-15/h6-7,14-15H,1-5,8-13H2,(H,20,27)