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

Systemtic Name: N-(4-bromanyl-3-methyl-phenyl)-5-methyl-4-pyrrolidin-1-yl-thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: N-(4-bromo-3-methyl-phenyl)-5-methyl-4-pyrrolidin-1-yl-thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: N-(4-bromo-3-methylphenyl)-5-methyl-4-(1-pyrrolidinyl)-6-thieno[2,3-d]pyrimidinecarboxamide IUPAC Name: N-(4-bromo-3-methylphenyl)-5-methyl-4-pyrrolidin-1-ylthieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: N-(4-bromo-3-methyl-phenyl)-5-methyl-4-pyrrolidino-thieno[2,3-d]pyrimidine-6-carboxamide Formula: C19H19BrN4OS MolecularWeight: 431.34936

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)C2=C(C3=C(N=CN=C3S2)N4CCCC4)C)Br

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)C2=C(C3=C(N=CN=C3S2)N4CCCC4)C)Br

InChI

InChI=1S/C19H19BrN4OS/c1-11-9-13(5-6-14(11)20)23-18(25)16-12(2)15-17(24-7-3-4-8-24)21-10-22-19(15)26-16/h5-6,9-10H,3-4,7-8H2,1-2H3,(H,23,25)