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

Systemtic Name: N-cyclopropyl-4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)piperazine-1-carbothioamide Openeye Name: N-cyclopropyl-4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)piperazine-1-carbothioamide CAS Name: N-cyclopropyl-4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-1-piperazinecarbothioamide IUPAC Name: N-cyclopropyl-4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)piperazine-1-carbothioamide Traditional Name: N-cyclopropyl-4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)piperazine-1-carbothioamide Formula: C16H21N3O4S2 MolecularWeight: 383.48564

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=S)N2CCN(CC2)S(=O)(=O)C3=CC4=C(C=C3)OCCO4

Isomeric SMILES

C1CC1NC(=S)N2CCN(CC2)S(=O)(=O)C3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C16H21N3O4S2/c20-25(21,13-3-4-14-15(11-13)23-10-9-22-14)19-7-5-18(6-8-19)16(24)17-12-1-2-12/h3-4,11-12H,1-2,5-10H2,(H,17,24)