2-(3-azanyl-4-oxidanylidene-2-propan-2-yl-2,3-dihydro-1,5-benzothiazepin-5-yl)ethanamide

Systemtic Name: 2-(3-azanyl-4-oxidanylidene-2-propan-2-yl-2,3-dihydro-1,5-benzothiazepin-5-yl)ethanamide Openeye Name: 2-(3-amino-2-isopropyl-4-oxo-2,3-dihydro-1,5-benzothiazepin-5-yl)acetamide CAS Name: 2-(3-amino-4-oxo-2-propan-2-yl-2,3-dihydro-1,5-benzothiazepin-5-yl)acetamide IUPAC Name: 2-(3-amino-4-oxo-2-propan-2-yl-2,3-dihydro-1,5-benzothiazepin-5-yl)acetamide Traditional Name: 2-(3-amino-2-isopropyl-4-keto-2,3-dihydro-1,5-benzothiazepin-5-yl)acetamide Formula: C14H19N3O2S MolecularWeight: 293.38456

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1C(C(=O)N(C2=CC=CC=C2S1)CC(=O)N)N

Isomeric SMILES

CC(C)C1C(C(=O)N(C2=CC=CC=C2S1)CC(=O)N)N

InChI

InChI=1S/C14H19N3O2S/c1-8(2)13-12(16)14(19)17(7-11(15)18)9-5-3-4-6-10(9)20-13/h3-6,8,12-13H,7,16H2,1-2H3,(H2,15,18)