4-oxidanylidene-N-[3-[(E)-2-pyridin-2-ylethenyl]phenyl]-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide

Systemtic Name: 4-oxidanylidene-N-[3-[(E)-2-pyridin-2-ylethenyl]phenyl]-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide Openeye Name: 4-oxo-N-[3-[(E)-2-(2-pyridyl)vinyl]phenyl]-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide CAS Name: 4-oxo-N-[3-[(E)-2-(2-pyridinyl)ethenyl]phenyl]-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide IUPAC Name: 4-oxo-N-[3-[(E)-2-pyridin-2-ylethenyl]phenyl]-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide Traditional Name: 4-keto-N-[3-[(E)-2-(2-pyridyl)vinyl]phenyl]-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide Formula: C23H19N3O2S MolecularWeight: 401.48086

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC2=C(C=C(C=C2)C(=O)NC3=CC=CC(=C3)C=CC4=CC=CC=N4)NC1=O

Isomeric SMILES

C1CSC2=C(C=C(C=C2)C(=O)NC3=CC=CC(=C3)/C=C/C4=CC=CC=N4)NC1=O

InChI

InChI=1S/C23H19N3O2S/c27-22-11-13-29-21-10-8-17(15-20(21)26-22)23(28)25-19-6-3-4-16(14-19)7-9-18-5-1-2-12-24-18/h1-10,12,14-15H,11,13H2,(H,25,28)(H,26,27)/b9-7+