2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-N-[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]ethanamide

Systemtic Name: 2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-N-[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]ethanamide Openeye Name: 2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-N-[4-(2-oxopyrrolidin-1-yl)phenyl]acetamide CAS Name: 2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-N-[4-(2-oxo-1-pyrrolidinyl)phenyl]acetamide IUPAC Name: 2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-N-[4-(2-oxopyrrolidin-1-yl)phenyl]acetamide Traditional Name: 2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-N-[4-(2-ketopyrrolidino)phenyl]acetamide Formula: C21H23N3O2S MolecularWeight: 381.49122

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)C2=CC=C(C=C2)NC(=O)CN3CCCSC4=CC=CC=C43

Isomeric SMILES

C1CC(=O)N(C1)C2=CC=C(C=C2)NC(=O)CN3CCCSC4=CC=CC=C43

InChI

InChI=1S/C21H23N3O2S/c25-20(15-23-12-4-14-27-19-6-2-1-5-18(19)23)22-16-8-10-17(11-9-16)24-13-3-7-21(24)26/h1-2,5-6,8-11H,3-4,7,12-15H2,(H,22,25)