methyl 4-[3-(3-azanyl-4-cyano-1H-pyrazol-5-yl)propyl-methyl-amino]-2,5-dimethyl-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: methyl 4-[3-(3-azanyl-4-cyano-1H-pyrazol-5-yl)propyl-methyl-amino]-2,5-dimethyl-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: methyl 4-[3-(3-amino-4-cyano-1H-pyrazol-5-yl)propyl-methyl-amino]-2,5-dimethyl-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 4-[3-(3-amino-4-cyano-1H-pyrazol-5-yl)propyl-methylamino]-2,5-dimethyl-6-thieno[2,3-d]pyrimidinecarboxylic acid methyl ester IUPAC Name: methyl 4-[3-(3-amino-4-cyano-1H-pyrazol-5-yl)propyl-methylamino]-2,5-dimethylthieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-[3-(3-amino-4-cyano-1H-pyrazol-5-yl)propyl-methyl-amino]-2,5-dimethyl-thieno[2,3-d]pyrimidine-6-carboxylic acid methyl ester Formula: C18H21N7O2S MolecularWeight: 399.47004

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC(=NC(=C12)N(C)CCCC3=C(C(=NN3)N)C#N)C)C(=O)OC

Isomeric SMILES

CC1=C(SC2=NC(=NC(=C12)N(C)CCCC3=C(C(=NN3)N)C#N)C)C(=O)OC

InChI

InChI=1S/C18H21N7O2S/c1-9-13-16(21-10(2)22-17(13)28-14(9)18(26)27-4)25(3)7-5-6-12-11(8-19)15(20)24-23-12/h5-7H2,1-4H3,(H3,20,23,24)