N-(3-chloranyl-2-methyl-phenyl)-5-methyl-4-oxidanylidene-3-(pyridin-4-ylmethyl)thieno[2,3-d]pyrimidine-6-carboxamide

Systemtic Name: N-(3-chloranyl-2-methyl-phenyl)-5-methyl-4-oxidanylidene-3-(pyridin-4-ylmethyl)thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: N-(3-chloro-2-methyl-phenyl)-5-methyl-4-oxo-3-(4-pyridylmethyl)thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: N-(3-chloro-2-methylphenyl)-5-methyl-4-oxo-3-(pyridin-4-ylmethyl)-6-thieno[2,3-d]pyrimidinecarboxamide IUPAC Name: N-(3-chloro-2-methylphenyl)-5-methyl-4-oxo-3-(pyridin-4-ylmethyl)thieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: N-(3-chloro-2-methyl-phenyl)-4-keto-5-methyl-3-(4-pyridylmethyl)thieno[2,3-d]pyrimidine-6-carboxamide Formula: C21H17ClN4O2S MolecularWeight: 424.90328

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NC(=O)C2=C(C3=C(S2)N=CN(C3=O)CC4=CC=NC=C4)C

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC(=O)C2=C(C3=C(S2)N=CN(C3=O)CC4=CC=NC=C4)C

InChI

InChI=1S/C21H17ClN4O2S/c1-12-15(22)4-3-5-16(12)25-19(27)18-13(2)17-20(29-18)24-11-26(21(17)28)10-14-6-8-23-9-7-14/h3-9,11H,10H2,1-2H3,(H,25,27)