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

Systemtic Name: 2-[2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)ethanoylamino]-N-propan-2-yl-ethanamide Openeye Name: 2-[[2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)acetyl]amino]-N-isopropyl-acetamide CAS Name: 2-[[2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-1-oxoethyl]amino]-N-propan-2-ylacetamide IUPAC Name: 2-[[2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)acetyl]amino]-N-propan-2-ylacetamide Traditional Name: 2-[[2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)acetyl]amino]-N-isopropyl-acetamide Formula: C16H23N3O2S MolecularWeight: 321.43772

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)CNC(=O)CN1CCCSC2=CC=CC=C21

Isomeric SMILES

CC(C)NC(=O)CNC(=O)CN1CCCSC2=CC=CC=C21

InChI

InChI=1S/C16H23N3O2S/c1-12(2)18-15(20)10-17-16(21)11-19-8-5-9-22-14-7-4-3-6-13(14)19/h3-4,6-7,12H,5,8-11H2,1-2H3,(H,17,21)(H,18,20)