N-(2-methoxy-5-methyl-phenyl)-2-methylsulfanyl-4-pyrrolidin-1-yl-thieno[2,3-d]pyrimidine-6-carboxamide

Systemtic Name: N-(2-methoxy-5-methyl-phenyl)-2-methylsulfanyl-4-pyrrolidin-1-yl-thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: N-(2-methoxy-5-methyl-phenyl)-2-methylsulfanyl-4-pyrrolidin-1-yl-thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: N-(2-methoxy-5-methylphenyl)-2-(methylthio)-4-(1-pyrrolidinyl)-6-thieno[2,3-d]pyrimidinecarboxamide IUPAC Name: N-(2-methoxy-5-methylphenyl)-2-methylsulfanyl-4-pyrrolidin-1-ylthieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: N-(2-methoxy-5-methyl-phenyl)-2-(methylthio)-4-pyrrolidino-thieno[2,3-d]pyrimidine-6-carboxamide Formula: C20H22N4O2S2 MolecularWeight: 414.54428

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)NC(=O)C2=CC3=C(N=C(N=C3S2)SC)N4CCCC4

Isomeric SMILES

CC1=CC(=C(C=C1)OC)NC(=O)C2=CC3=C(N=C(N=C3S2)SC)N4CCCC4

InChI

InChI=1S/C20H22N4O2S2/c1-12-6-7-15(26-2)14(10-12)21-18(25)16-11-13-17(24-8-4-5-9-24)22-20(27-3)23-19(13)28-16/h6-7,10-11H,4-5,8-9H2,1-3H3,(H,21,25)