7-[4-(furan-2-ylcarbonyl)piperazin-1-yl]sulfonyl-3,5-dihydro-2H-1,5-benzothiazepin-4-one

Systemtic Name: 7-[4-(furan-2-ylcarbonyl)piperazin-1-yl]sulfonyl-3,5-dihydro-2H-1,5-benzothiazepin-4-one Openeye Name: 7-[4-(furan-2-carbonyl)piperazin-1-yl]sulfonyl-3,5-dihydro-2H-1,5-benzothiazepin-4-one CAS Name: 7-[[4-[2-furanyl(oxo)methyl]-1-piperazinyl]sulfonyl]-3,5-dihydro-2H-1,5-benzothiazepin-4-one IUPAC Name: 7-[4-(furan-2-carbonyl)piperazin-1-yl]sulfonyl-3,5-dihydro-2H-1,5-benzothiazepin-4-one Traditional Name: 7-[4-(2-furoyl)piperazino]sulfonyl-3,5-dihydro-2H-1,5-benzothiazepin-4-one Formula: C18H19N3O5S2 MolecularWeight: 421.49056

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC2=C(C=C(C=C2)S(=O)(=O)N3CCN(CC3)C(=O)C4=CC=CO4)NC1=O

Isomeric SMILES

C1CSC2=C(C=C(C=C2)S(=O)(=O)N3CCN(CC3)C(=O)C4=CC=CO4)NC1=O

InChI

InChI=1S/C18H19N3O5S2/c22-17-5-11-27-16-4-3-13(12-14(16)19-17)28(24,25)21-8-6-20(7-9-21)18(23)15-2-1-10-26-15/h1-4,10,12H,5-9,11H2,(H,19,22)