N-[[(2R)-butan-2-yl]carbamoyl]-2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)ethanamide

Systemtic Name: N-[[(2R)-butan-2-yl]carbamoyl]-2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)ethanamide Openeye Name: 2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-N-[[(1R)-1-methylpropyl]carbamoyl]acetamide CAS Name: N-[[[(2R)-butan-2-yl]amino]-oxomethyl]-2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)acetamide IUPAC Name: N-[[(2R)-butan-2-yl]carbamoyl]-2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)acetamide Traditional Name: 2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-N-[[(1R)-1-methylpropyl]carbamoyl]acetamide Formula: C16H23N3O2S MolecularWeight: 321.43772

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC[C@@H](C)NC(=O)NC(=O)CN1CCCSC2=CC=CC=C21

InChI

InChI=1S/C16H23N3O2S/c1-3-12(2)17-16(21)18-15(20)11-19-9-6-10-22-14-8-5-4-7-13(14)19/h4-5,7-8,12H,3,6,9-11H2,1-2H3,(H2,17,18,20,21)/t12-/m1/s1