N-[4-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)piperazin-1-yl]carbonyl-1,3-thiazol-2-yl]ethanamide

Systemtic Name: N-[4-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)piperazin-1-yl]carbonyl-1,3-thiazol-2-yl]ethanamide Openeye Name: N-[4-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)piperazine-1-carbonyl]thiazol-2-yl]acetamide CAS Name: N-[4-[[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)-1-piperazinyl]-oxomethyl]-2-thiazolyl]acetamide IUPAC Name: N-[4-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)piperazine-1-carbonyl]-1,3-thiazol-2-yl]acetamide Traditional Name: N-[4-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)piperazine-1-carbonyl]thiazol-2-yl]acetamide Formula: C19H22N4O6S2 MolecularWeight: 466.53118

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=NC(=CS1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC4=C(C=C3)OCCCO4

Isomeric SMILES

CC(=O)NC1=NC(=CS1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC4=C(C=C3)OCCCO4

InChI

InChI=1S/C19H22N4O6S2/c1-13(24)20-19-21-15(12-30-19)18(25)22-5-7-23(8-6-22)31(26,27)14-3-4-16-17(11-14)29-10-2-9-28-16/h3-4,11-12H,2,5-10H2,1H3,(H,20,21,24)