2-(2-oxidanylidenecycloheptyl)sulfanyl-3-phenyl-thieno[3,2-d]pyrimidin-4-one

Systemtic Name: 2-(2-oxidanylidenecycloheptyl)sulfanyl-3-phenyl-thieno[3,2-d]pyrimidin-4-one Openeye Name: 2-(2-oxocycloheptyl)sulfanyl-3-phenyl-thieno[3,2-d]pyrimidin-4-one CAS Name: 2-[(2-oxocycloheptyl)thio]-3-phenyl-4-thieno[3,2-d]pyrimidinone IUPAC Name: 2-(2-oxocycloheptyl)sulfanyl-3-phenylthieno[3,2-d]pyrimidin-4-one Traditional Name: 2-[(2-ketocycloheptyl)thio]-3-phenyl-thieno[3,2-d]pyrimidin-4-one Formula: C19H18N2O2S2 MolecularWeight: 370.48842

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(=O)CC1)SC2=NC3=C(C(=O)N2C4=CC=CC=C4)SC=C3

Isomeric SMILES

C1CCC(C(=O)CC1)SC2=NC3=C(C(=O)N2C4=CC=CC=C4)SC=C3

InChI

InChI=1S/C19H18N2O2S2/c22-15-9-5-2-6-10-16(15)25-19-20-14-11-12-24-17(14)18(23)21(19)13-7-3-1-4-8-13/h1,3-4,7-8,11-12,16H,2,5-6,9-10H2