7-(4-cyclopentylpiperazin-1-yl)sulfonyl-3-methyl-3,5-dihydro-2H-1,5-benzothiazepin-4-one

Systemtic Name: 7-(4-cyclopentylpiperazin-1-yl)sulfonyl-3-methyl-3,5-dihydro-2H-1,5-benzothiazepin-4-one Openeye Name: 7-(4-cyclopentylpiperazin-1-yl)sulfonyl-3-methyl-3,5-dihydro-2H-1,5-benzothiazepin-4-one CAS Name: 7-[(4-cyclopentyl-1-piperazinyl)sulfonyl]-3-methyl-3,5-dihydro-2H-1,5-benzothiazepin-4-one IUPAC Name: 7-(4-cyclopentylpiperazin-1-yl)sulfonyl-3-methyl-3,5-dihydro-2H-1,5-benzothiazepin-4-one Traditional Name: 7-(4-cyclopentylpiperazino)sulfonyl-3-methyl-3,5-dihydro-2H-1,5-benzothiazepin-4-one Formula: C19H27N3O3S2 MolecularWeight: 409.56598

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Descriptors Computed from Structure

Canonical SMILES:

CC1CSC2=C(C=C(C=C2)S(=O)(=O)N3CCN(CC3)C4CCCC4)NC1=O

Isomeric SMILES

CC1CSC2=C(C=C(C=C2)S(=O)(=O)N3CCN(CC3)C4CCCC4)NC1=O

InChI

InChI=1S/C19H27N3O3S2/c1-14-13-26-18-7-6-16(12-17(18)20-19(14)23)27(24,25)22-10-8-21(9-11-22)15-4-2-3-5-15/h6-7,12,14-15H,2-5,8-11,13H2,1H3,(H,20,23)