N-[3-[[3-(6-azanylpyrimidin-4-yl)pyridin-2-yl]amino]-4-methyl-phenyl]-5-tert-butyl-thiophene-2-carboxamide

Systemtic Name: N-[3-[[3-(6-azanylpyrimidin-4-yl)pyridin-2-yl]amino]-4-methyl-phenyl]-5-tert-butyl-thiophene-2-carboxamide Openeye Name: N-[3-[[3-(6-aminopyrimidin-4-yl)-2-pyridyl]amino]-4-methyl-phenyl]-5-tert-butyl-thiophene-2-carboxamide CAS Name: N-[3-[[3-(6-amino-4-pyrimidinyl)-2-pyridinyl]amino]-4-methylphenyl]-5-tert-butyl-2-thiophenecarboxamide IUPAC Name: N-[3-[[3-(6-aminopyrimidin-4-yl)pyridin-2-yl]amino]-4-methylphenyl]-5-tert-butylthiophene-2-carboxamide Traditional Name: N-[3-[[3-(6-aminopyrimidin-4-yl)-2-pyridyl]amino]-4-methyl-phenyl]-5-tert-butyl-thiophene-2-carboxamide Formula: C25H26N6OS MolecularWeight: 458.57854

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=CC=C(S2)C(C)(C)C)NC3=C(C=CC=N3)C4=CC(=NC=N4)N

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=CC=C(S2)C(C)(C)C)NC3=C(C=CC=N3)C4=CC(=NC=N4)N

InChI

InChI=1S/C25H26N6OS/c1-15-7-8-16(30-24(32)20-9-10-21(33-20)25(2,3)4)12-18(15)31-23-17(6-5-11-27-23)19-13-22(26)29-14-28-19/h5-14H,1-4H3,(H,27,31)(H,30,32)(H2,26,28,29)