N-(2,5-dimethylpyrazol-3-yl)-4-oxidanylidene-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide

Systemtic Name: N-(2,5-dimethylpyrazol-3-yl)-4-oxidanylidene-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide Openeye Name: N-(2,5-dimethylpyrazol-3-yl)-4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide CAS Name: N-(2,5-dimethyl-3-pyrazolyl)-4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide IUPAC Name: N-(2,5-dimethylpyrazol-3-yl)-4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide Traditional Name: N-(2,5-dimethylpyrazol-3-yl)-4-keto-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide Formula: C15H16N4O2S MolecularWeight: 316.37814

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)NC(=O)C2=CC3=C(C=C2)SCCC(=O)N3)C

Isomeric SMILES

CC1=NN(C(=C1)NC(=O)C2=CC3=C(C=C2)SCCC(=O)N3)C

InChI

InChI=1S/C15H16N4O2S/c1-9-7-13(19(2)18-9)17-15(21)10-3-4-12-11(8-10)16-14(20)5-6-22-12/h3-4,7-8H,5-6H2,1-2H3,(H,16,20)(H,17,21)