3-azanyl-2-[(7-methyl-2-oxidanylidene-chromen-4-yl)methylsulfanyl]-5-phenyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 3-azanyl-2-[(7-methyl-2-oxidanylidene-chromen-4-yl)methylsulfanyl]-5-phenyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-amino-2-[(7-methyl-2-oxo-chromen-4-yl)methylsulfanyl]-5-phenyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 3-amino-2-[(7-methyl-2-oxo-1-benzopyran-4-yl)methylthio]-5-phenyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-amino-2-[(7-methyl-2-oxochromen-4-yl)methylsulfanyl]-5-phenylthieno[2,3-d]pyrimidin-4-one Traditional Name: 3-amino-2-[(2-keto-7-methyl-chromen-4-yl)methylthio]-5-phenyl-thieno[2,3-d]pyrimidin-4-one Formula: C23H17N3O3S2 MolecularWeight: 447.52938

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=CC(=O)O2)CSC3=NC4=C(C(=CS4)C5=CC=CC=C5)C(=O)N3N

Isomeric SMILES

CC1=CC2=C(C=C1)C(=CC(=O)O2)CSC3=NC4=C(C(=CS4)C5=CC=CC=C5)C(=O)N3N

InChI

InChI=1S/C23H17N3O3S2/c1-13-7-8-16-15(10-19(27)29-18(16)9-13)11-31-23-25-21-20(22(28)26(23)24)17(12-30-21)14-5-3-2-4-6-14/h2-10,12H,11,24H2,1H3