ethyl 4-azanyl-2-[(5-cyano-2,6-dimethyl-pyrimidin-4-yl)sulfanylmethyl]-6-methyl-furo[2,3-d]pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-azanyl-2-[(5-cyano-2,6-dimethyl-pyrimidin-4-yl)sulfanylmethyl]-6-methyl-furo[2,3-d]pyrimidine-5-carboxylate Openeye Name: ethyl 4-amino-2-[(5-cyano-2,6-dimethyl-pyrimidin-4-yl)sulfanylmethyl]-6-methyl-furo[2,3-d]pyrimidine-5-carboxylate CAS Name: 4-amino-2-[[(5-cyano-2,6-dimethyl-4-pyrimidinyl)thio]methyl]-6-methyl-5-furo[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-amino-2-[(5-cyano-2,6-dimethylpyrimidin-4-yl)sulfanylmethyl]-6-methylfuro[2,3-d]pyrimidine-5-carboxylate Traditional Name: 4-amino-2-[[(5-cyano-2,6-dimethyl-pyrimidin-4-yl)thio]methyl]-6-methyl-furo[2,3-d]pyrimidine-5-carboxylic acid ethyl ester Formula: C18H18N6O3S MolecularWeight: 398.43892

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC2=NC(=NC(=C12)N)CSC3=NC(=NC(=C3C#N)C)C)C

Isomeric SMILES

CCOC(=O)C1=C(OC2=NC(=NC(=C12)N)CSC3=NC(=NC(=C3C#N)C)C)C

InChI

InChI=1S/C18H18N6O3S/c1-5-26-18(25)13-9(3)27-16-14(13)15(20)23-12(24-16)7-28-17-11(6-19)8(2)21-10(4)22-17/h5,7H2,1-4H3,(H2,20,23,24)