N-(furan-2-ylmethyl)-2-(7-morpholin-4-ylsulfonyl-4-oxidanylidene-2,3-dihydro-1,5-benzothiazepin-5-yl)ethanamide

Systemtic Name: N-(furan-2-ylmethyl)-2-(7-morpholin-4-ylsulfonyl-4-oxidanylidene-2,3-dihydro-1,5-benzothiazepin-5-yl)ethanamide Openeye Name: N-(2-furylmethyl)-2-(7-morpholinosulfonyl-4-oxo-2,3-dihydro-1,5-benzothiazepin-5-yl)acetamide CAS Name: N-(2-furanylmethyl)-2-[7-(4-morpholinylsulfonyl)-4-oxo-2,3-dihydro-1,5-benzothiazepin-5-yl]acetamide IUPAC Name: N-(furan-2-ylmethyl)-2-(7-morpholin-4-ylsulfonyl-4-oxo-2,3-dihydro-1,5-benzothiazepin-5-yl)acetamide Traditional Name: N-(2-furfuryl)-2-(4-keto-7-morpholinosulfonyl-2,3-dihydro-1,5-benzothiazepin-5-yl)acetamide Formula: C20H23N3O6S2 MolecularWeight: 465.54312

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N(C1=O)CC(=O)NCC4=CC=CO4

Isomeric SMILES

C1CSC2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N(C1=O)CC(=O)NCC4=CC=CO4

InChI

InChI=1S/C20H23N3O6S2/c24-19(21-13-15-2-1-8-29-15)14-23-17-12-16(3-4-18(17)30-11-5-20(23)25)31(26,27)22-6-9-28-10-7-22/h1-4,8,12H,5-7,9-11,13-14H2,(H,21,24)