3-(4,6-dimethylpyrimidin-2-yl)sulfanyl-1,3,4,5-tetrahydro-1-benzazepin-2-one

Systemtic Name: 3-(4,6-dimethylpyrimidin-2-yl)sulfanyl-1,3,4,5-tetrahydro-1-benzazepin-2-one Openeye Name: 3-(4,6-dimethylpyrimidin-2-yl)sulfanyl-1,3,4,5-tetrahydro-1-benzazepin-2-one CAS Name: 3-[(4,6-dimethyl-2-pyrimidinyl)thio]-1,3,4,5-tetrahydro-1-benzazepin-2-one IUPAC Name: 3-(4,6-dimethylpyrimidin-2-yl)sulfanyl-1,3,4,5-tetrahydro-1-benzazepin-2-one Traditional Name: 3-[(4,6-dimethylpyrimidin-2-yl)thio]-1,3,4,5-tetrahydro-1-benzazepin-2-one Formula: C16H17N3OS MolecularWeight: 299.39068

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SC2CCC3=CC=CC=C3NC2=O)C

Isomeric SMILES

CC1=CC(=NC(=N1)SC2CCC3=CC=CC=C3NC2=O)C

InChI

InChI=1S/C16H17N3OS/c1-10-9-11(2)18-16(17-10)21-14-8-7-12-5-3-4-6-13(12)19-15(14)20/h3-6,9,14H,7-8H2,1-2H3,(H,19,20)