7-(2-thieno[3,2-d]pyrimidin-4-ylsulfanylethanoyl)-1,3,4,5-tetrahydro-1-benzazepin-2-one

Systemtic Name: 7-(2-thieno[3,2-d]pyrimidin-4-ylsulfanylethanoyl)-1,3,4,5-tetrahydro-1-benzazepin-2-one Openeye Name: 7-(2-thieno[3,2-d]pyrimidin-4-ylsulfanylacetyl)-1,3,4,5-tetrahydro-1-benzazepin-2-one CAS Name: 7-[1-oxo-2-(4-thieno[3,2-d]pyrimidinylthio)ethyl]-1,3,4,5-tetrahydro-1-benzazepin-2-one IUPAC Name: 7-(2-thieno[3,2-d]pyrimidin-4-ylsulfanylacetyl)-1,3,4,5-tetrahydro-1-benzazepin-2-one Traditional Name: 7-[2-(thieno[3,2-d]pyrimidin-4-ylthio)acetyl]-1,3,4,5-tetrahydro-1-benzazepin-2-one Formula: C18H15N3O2S2 MolecularWeight: 369.4606

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C=CC(=C2)C(=O)CSC3=NC=NC4=C3SC=C4)NC(=O)C1

Isomeric SMILES

C1CC2=C(C=CC(=C2)C(=O)CSC3=NC=NC4=C3SC=C4)NC(=O)C1

InChI

InChI=1S/C18H15N3O2S2/c22-15(9-25-18-17-14(6-7-24-17)19-10-20-18)12-4-5-13-11(8-12)2-1-3-16(23)21-13/h4-8,10H,1-3,9H2,(H,21,23)