N-(2-methoxy-5-methyl-phenyl)-2-(3-methyl-7-morpholin-4-ylsulfonyl-4-oxidanylidene-2,3-dihydro-1,5-benzothiazepin-5-yl)ethanamide

Systemtic Name: N-(2-methoxy-5-methyl-phenyl)-2-(3-methyl-7-morpholin-4-ylsulfonyl-4-oxidanylidene-2,3-dihydro-1,5-benzothiazepin-5-yl)ethanamide Openeye Name: N-(2-methoxy-5-methyl-phenyl)-2-(3-methyl-7-morpholinosulfonyl-4-oxo-2,3-dihydro-1,5-benzothiazepin-5-yl)acetamide CAS Name: N-(2-methoxy-5-methylphenyl)-2-[3-methyl-7-(4-morpholinylsulfonyl)-4-oxo-2,3-dihydro-1,5-benzothiazepin-5-yl]acetamide IUPAC Name: N-(2-methoxy-5-methylphenyl)-2-(3-methyl-7-morpholin-4-ylsulfonyl-4-oxo-2,3-dihydro-1,5-benzothiazepin-5-yl)acetamide Traditional Name: 2-(4-keto-3-methyl-7-morpholinosulfonyl-2,3-dihydro-1,5-benzothiazepin-5-yl)-N-(2-methoxy-5-methyl-phenyl)acetamide Formula: C24H29N3O6S2 MolecularWeight: 519.63356

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Descriptors Computed from Structure

Canonical SMILES:

CC1CSC2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N(C1=O)CC(=O)NC4=C(C=CC(=C4)C)OC

Isomeric SMILES

CC1CSC2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N(C1=O)CC(=O)NC4=C(C=CC(=C4)C)OC

InChI

InChI=1S/C24H29N3O6S2/c1-16-4-6-21(32-3)19(12-16)25-23(28)14-27-20-13-18(35(30,31)26-8-10-33-11-9-26)5-7-22(20)34-15-17(2)24(27)29/h4-7,12-13,17H,8-11,14-15H2,1-3H3,(H,25,28)