4-azanyl-2-[[6-methyl-5-(4-methylphenyl)-4-oxidanylidene-3H-thieno[2,3-d]pyrimidin-2-yl]methylsulfanyl]pyrimidine-5-carbonitrile

Systemtic Name: 4-azanyl-2-[[6-methyl-5-(4-methylphenyl)-4-oxidanylidene-3H-thieno[2,3-d]pyrimidin-2-yl]methylsulfanyl]pyrimidine-5-carbonitrile Openeye Name: 4-amino-2-[[6-methyl-4-oxo-5-(p-tolyl)-3H-thieno[2,3-d]pyrimidin-2-yl]methylsulfanyl]pyrimidine-5-carbonitrile CAS Name: 4-amino-2-[[6-methyl-5-(4-methylphenyl)-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl]methylthio]-5-pyrimidinecarbonitrile IUPAC Name: 4-amino-2-[[6-methyl-5-(4-methylphenyl)-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl]methylsulfanyl]pyrimidine-5-carbonitrile Traditional Name: 4-amino-2-[[4-keto-6-methyl-5-(p-tolyl)-3H-thieno[2,3-d]pyrimidin-2-yl]methylthio]pyrimidine-5-carbonitrile Formula: C20H16N6OS2 MolecularWeight: 420.51064

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(SC3=C2C(=O)NC(=N3)CSC4=NC=C(C(=N4)N)C#N)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(SC3=C2C(=O)NC(=N3)CSC4=NC=C(C(=N4)N)C#N)C

InChI

InChI=1S/C20H16N6OS2/c1-10-3-5-12(6-4-10)15-11(2)29-19-16(15)18(27)24-14(25-19)9-28-20-23-8-13(7-21)17(22)26-20/h3-6,8H,9H2,1-2H3,(H2,22,23,26)(H,24,25,27)