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

Systemtic Name: N-(2-bromanyl-4-methyl-phenyl)-2,5-dimethyl-4-piperidin-1-yl-thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: N-(2-bromo-4-methyl-phenyl)-2,5-dimethyl-4-(1-piperidyl)thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: N-(2-bromo-4-methylphenyl)-2,5-dimethyl-4-(1-piperidinyl)-6-thieno[2,3-d]pyrimidinecarboxamide IUPAC Name: N-(2-bromo-4-methylphenyl)-2,5-dimethyl-4-piperidin-1-ylthieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: N-(2-bromo-4-methyl-phenyl)-2,5-dimethyl-4-piperidino-thieno[2,3-d]pyrimidine-6-carboxamide Formula: C21H23BrN4OS MolecularWeight: 459.40252

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)C2=C(C3=C(N=C(N=C3S2)C)N4CCCCC4)C)Br

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)C2=C(C3=C(N=C(N=C3S2)C)N4CCCCC4)C)Br

InChI

InChI=1S/C21H23BrN4OS/c1-12-7-8-16(15(22)11-12)25-20(27)18-13(2)17-19(26-9-5-4-6-10-26)23-14(3)24-21(17)28-18/h7-8,11H,4-6,9-10H2,1-3H3,(H,25,27)