N-(3-methoxyphenyl)-2-methylsulfanyl-4-pyrrolidin-1-yl-thieno[2,3-d]pyrimidine-6-carboxamide

Systemtic Name: N-(3-methoxyphenyl)-2-methylsulfanyl-4-pyrrolidin-1-yl-thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: N-(3-methoxyphenyl)-2-methylsulfanyl-4-pyrrolidin-1-yl-thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: N-(3-methoxyphenyl)-2-(methylthio)-4-(1-pyrrolidinyl)-6-thieno[2,3-d]pyrimidinecarboxamide IUPAC Name: N-(3-methoxyphenyl)-2-methylsulfanyl-4-pyrrolidin-1-ylthieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: N-(3-methoxyphenyl)-2-(methylthio)-4-pyrrolidino-thieno[2,3-d]pyrimidine-6-carboxamide Formula: C19H20N4O2S2 MolecularWeight: 400.5177

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC(=O)C2=CC3=C(N=C(N=C3S2)SC)N4CCCC4

Isomeric SMILES

COC1=CC=CC(=C1)NC(=O)C2=CC3=C(N=C(N=C3S2)SC)N4CCCC4

InChI

InChI=1S/C19H20N4O2S2/c1-25-13-7-5-6-12(10-13)20-17(24)15-11-14-16(23-8-3-4-9-23)21-19(26-2)22-18(14)27-15/h5-7,10-11H,3-4,8-9H2,1-2H3,(H,20,24)