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

Systemtic Name: 2,5-dimethyl-N-[(4-methylsulfanylphenyl)methyl]-4-pyrrolidin-1-yl-thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: 2,5-dimethyl-N-[(4-methylsulfanylphenyl)methyl]-4-pyrrolidin-1-yl-thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: 2,5-dimethyl-N-[[4-(methylthio)phenyl]methyl]-4-(1-pyrrolidinyl)-6-thieno[2,3-d]pyrimidinecarboxamide IUPAC Name: 2,5-dimethyl-N-[(4-methylsulfanylphenyl)methyl]-4-pyrrolidin-1-ylthieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: 2,5-dimethyl-N-[4-(methylthio)benzyl]-4-pyrrolidino-thieno[2,3-d]pyrimidine-6-carboxamide Formula: C21H24N4OS2 MolecularWeight: 412.57146

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC(=NC(=C12)N3CCCC3)C)C(=O)NCC4=CC=C(C=C4)SC

Isomeric SMILES

CC1=C(SC2=NC(=NC(=C12)N3CCCC3)C)C(=O)NCC4=CC=C(C=C4)SC

InChI

InChI=1S/C21H24N4OS2/c1-13-17-19(25-10-4-5-11-25)23-14(2)24-21(17)28-18(13)20(26)22-12-15-6-8-16(27-3)9-7-15/h6-9H,4-5,10-12H2,1-3H3,(H,22,26)