3-[(6-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]-1,3,4,5-tetrahydro-1-benzazepin-2-one

Systemtic Name: 3-[(6-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]-1,3,4,5-tetrahydro-1-benzazepin-2-one Openeye Name: 3-[(6-oxo-1H-pyrimidin-2-yl)sulfanyl]-1,3,4,5-tetrahydro-1-benzazepin-2-one CAS Name: 3-[(6-oxo-1H-pyrimidin-2-yl)thio]-1,3,4,5-tetrahydro-1-benzazepin-2-one IUPAC Name: 3-[(6-oxo-1H-pyrimidin-2-yl)sulfanyl]-1,3,4,5-tetrahydro-1-benzazepin-2-one Traditional Name: 3-[(6-keto-1H-pyrimidin-2-yl)thio]-1,3,4,5-tetrahydro-1-benzazepin-2-one Formula: C14H13N3O2S MolecularWeight: 287.33692

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=CC=CC=C2NC(=O)C1SC3=NC=CC(=O)N3

Isomeric SMILES

C1CC2=CC=CC=C2NC(=O)C1SC3=NC=CC(=O)N3

InChI

InChI=1S/C14H13N3O2S/c18-12-7-8-15-14(17-12)20-11-6-5-9-3-1-2-4-10(9)16-13(11)19/h1-4,7-8,11H,5-6H2,(H,16,19)(H,15,17,18)