3-(3-methoxyphenyl)-4-oxidanylidene-7-pentylsulfanyl-pyrido[2,3-d]pyrimidine-6-carbonitrile

Systemtic Name: 3-(3-methoxyphenyl)-4-oxidanylidene-7-pentylsulfanyl-pyrido[2,3-d]pyrimidine-6-carbonitrile Openeye Name: 3-(3-methoxyphenyl)-4-oxo-7-pentylsulfanyl-pyrido[2,3-d]pyrimidine-6-carbonitrile CAS Name: 3-(3-methoxyphenyl)-4-oxo-7-(pentylthio)-6-pyrido[2,3-d]pyrimidinecarbonitrile IUPAC Name: 3-(3-methoxyphenyl)-4-oxo-7-pentylsulfanylpyrido[2,3-d]pyrimidine-6-carbonitrile Traditional Name: 7-(amylthio)-4-keto-3-(3-methoxyphenyl)pyrido[2,3-d]pyrimidine-6-carbonitrile Formula: C20H20N4O2S MolecularWeight: 380.4634

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCSC1=NC2=C(C=C1C#N)C(=O)N(C=N2)C3=CC(=CC=C3)OC

Isomeric SMILES

CCCCCSC1=NC2=C(C=C1C#N)C(=O)N(C=N2)C3=CC(=CC=C3)OC

InChI

InChI=1S/C20H20N4O2S/c1-3-4-5-9-27-19-14(12-21)10-17-18(23-19)22-13-24(20(17)25)15-7-6-8-16(11-15)26-2/h6-8,10-11,13H,3-5,9H2,1-2H3