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

Systemtic Name: N-[4-(cyanomethyl)phenyl]-2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)ethanamide Openeye Name: N-[4-(cyanomethyl)phenyl]-2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)acetamide CAS Name: N-[4-(cyanomethyl)phenyl]-2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)acetamide IUPAC Name: N-[4-(cyanomethyl)phenyl]-2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)acetamide Traditional Name: N-[4-(cyanomethyl)phenyl]-2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)acetamide Formula: C19H19N3OS MolecularWeight: 337.43866

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C2=CC=CC=C2SC1)CC(=O)NC3=CC=C(C=C3)CC#N

Isomeric SMILES

C1CN(C2=CC=CC=C2SC1)CC(=O)NC3=CC=C(C=C3)CC#N

InChI

InChI=1S/C19H19N3OS/c20-11-10-15-6-8-16(9-7-15)21-19(23)14-22-12-3-13-24-18-5-2-1-4-17(18)22/h1-2,4-9H,3,10,12-14H2,(H,21,23)