5-(3-methoxy-4-oxidanyl-phenyl)-1-methyl-2-prop-2-ynylsulfanyl-6,8-dihydro-5H-pyrido[2,3-d]pyrimidine-4,7-dione

Systemtic Name: 5-(3-methoxy-4-oxidanyl-phenyl)-1-methyl-2-prop-2-ynylsulfanyl-6,8-dihydro-5H-pyrido[2,3-d]pyrimidine-4,7-dione Openeye Name: 5-(4-hydroxy-3-methoxy-phenyl)-1-methyl-2-prop-2-ynylsulfanyl-6,8-dihydro-5H-pyrido[2,3-d]pyrimidine-4,7-dione CAS Name: 5-(4-hydroxy-3-methoxyphenyl)-1-methyl-2-(prop-2-ynylthio)-6,8-dihydro-5H-pyrido[2,3-d]pyrimidine-4,7-dione IUPAC Name: 5-(4-hydroxy-3-methoxyphenyl)-1-methyl-2-prop-2-ynylsulfanyl-6,8-dihydro-5H-pyrido[2,3-d]pyrimidine-4,7-dione Traditional Name: 5-(4-hydroxy-3-methoxy-phenyl)-1-methyl-2-(propargylthio)-6,8-dihydro-5H-pyrido[2,3-d]pyrimidine-4,7-quinone Formula: C18H17N3O4S MolecularWeight: 371.41028

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(CC(=O)N2)C3=CC(=C(C=C3)O)OC)C(=O)N=C1SCC#C

Isomeric SMILES

CN1C2=C(C(CC(=O)N2)C3=CC(=C(C=C3)O)OC)C(=O)N=C1SCC#C

InChI

InChI=1S/C18H17N3O4S/c1-4-7-26-18-20-17(24)15-11(9-14(23)19-16(15)21(18)2)10-5-6-12(22)13(8-10)25-3/h1,5-6,8,11,22H,7,9H2,2-3H3,(H,19,23)