7-[2-(3-chloranylpyridin-2-yl)sulfanylethanoyl]-1,3,4,5-tetrahydro-1-benzazepin-2-one

Systemtic Name: 7-[2-(3-chloranylpyridin-2-yl)sulfanylethanoyl]-1,3,4,5-tetrahydro-1-benzazepin-2-one Openeye Name: 7-[2-[(3-chloro-2-pyridyl)sulfanyl]acetyl]-1,3,4,5-tetrahydro-1-benzazepin-2-one CAS Name: 7-[2-[(3-chloro-2-pyridinyl)thio]-1-oxoethyl]-1,3,4,5-tetrahydro-1-benzazepin-2-one IUPAC Name: 7-[2-(3-chloropyridin-2-yl)sulfanylacetyl]-1,3,4,5-tetrahydro-1-benzazepin-2-one Traditional Name: 7-[2-[(3-chloro-2-pyridyl)thio]acetyl]-1,3,4,5-tetrahydro-1-benzazepin-2-one Formula: C17H15ClN2O2S MolecularWeight: 346.8312

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C=CC(=C2)C(=O)CSC3=C(C=CC=N3)Cl)NC(=O)C1

Isomeric SMILES

C1CC2=C(C=CC(=C2)C(=O)CSC3=C(C=CC=N3)Cl)NC(=O)C1

InChI

InChI=1S/C17H15ClN2O2S/c18-13-4-2-8-19-17(13)23-10-15(21)12-6-7-14-11(9-12)3-1-5-16(22)20-14/h2,4,6-9H,1,3,5,10H2,(H,20,22)