N-[(1R)-1-cyano-1-cyclopropyl-ethyl]-2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)ethanamide

Systemtic Name: N-[(1R)-1-cyano-1-cyclopropyl-ethyl]-2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)ethanamide Openeye Name: N-[(1R)-1-cyano-1-cyclopropyl-ethyl]-2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)acetamide CAS Name: N-[(1R)-1-cyano-1-cyclopropylethyl]-2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)acetamide IUPAC Name: N-[(1R)-1-cyano-1-cyclopropylethyl]-2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)acetamide Traditional Name: N-[(1R)-1-cyano-1-cyclopropyl-ethyl]-2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)acetamide Formula: C17H21N3OS MolecularWeight: 315.43314

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#N)(C1CC1)NC(=O)CN2CCCSC3=CC=CC=C32

Isomeric SMILES

C[C@](C#N)(C1CC1)NC(=O)CN2CCCSC3=CC=CC=C32

InChI

InChI=1S/C17H21N3OS/c1-17(12-18,13-7-8-13)19-16(21)11-20-9-4-10-22-15-6-3-2-5-14(15)20/h2-3,5-6,13H,4,7-11H2,1H3,(H,19,21)/t17-/m0/s1