4-oxidanylidene-N-[3-(1H-pyrazol-5-yl)phenyl]-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide

Systemtic Name: 4-oxidanylidene-N-[3-(1H-pyrazol-5-yl)phenyl]-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide Openeye Name: 4-oxo-N-[3-(1H-pyrazol-5-yl)phenyl]-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide CAS Name: 4-oxo-N-[3-(1H-pyrazol-5-yl)phenyl]-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide IUPAC Name: 4-oxo-N-[3-(1H-pyrazol-5-yl)phenyl]-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide Traditional Name: 4-keto-N-[3-(1H-pyrazol-5-yl)phenyl]-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide Formula: C19H16N4O2S MolecularWeight: 364.42094

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC2=C(C=C(C=C2)C(=O)NC3=CC=CC(=C3)C4=CC=NN4)NC1=O

Isomeric SMILES

C1CSC2=C(C=C(C=C2)C(=O)NC3=CC=CC(=C3)C4=CC=NN4)NC1=O

InChI

InChI=1S/C19H16N4O2S/c24-18-7-9-26-17-5-4-13(11-16(17)22-18)19(25)21-14-3-1-2-12(10-14)15-6-8-20-23-15/h1-6,8,10-11H,7,9H2,(H,20,23)(H,21,25)(H,22,24)