N-[3-[[1-(6-azanylpyrimidin-4-yl)benzimidazol-2-yl]amino]-4-methyl-phenyl]-5-tert-butyl-thiophene-2-carboxamide

Systemtic Name: N-[3-[[1-(6-azanylpyrimidin-4-yl)benzimidazol-2-yl]amino]-4-methyl-phenyl]-5-tert-butyl-thiophene-2-carboxamide Openeye Name: N-[3-[[1-(6-aminopyrimidin-4-yl)benzimidazol-2-yl]amino]-4-methyl-phenyl]-5-tert-butyl-thiophene-2-carboxamide CAS Name: N-[3-[[1-(6-amino-4-pyrimidinyl)-2-benzimidazolyl]amino]-4-methylphenyl]-5-tert-butyl-2-thiophenecarboxamide IUPAC Name: N-[3-[[1-(6-aminopyrimidin-4-yl)benzimidazol-2-yl]amino]-4-methylphenyl]-5-tert-butylthiophene-2-carboxamide Traditional Name: N-[3-[[1-(6-aminopyrimidin-4-yl)benzimidazol-2-yl]amino]-4-methyl-phenyl]-5-tert-butyl-thiophene-2-carboxamide Formula: C27H27N7OS MolecularWeight: 497.61458

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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=NC4=CC=CC=C4N3C5=CC(=NC=N5)N

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=CC=C(S2)C(C)(C)C)NC3=NC4=CC=CC=C4N3C5=CC(=NC=N5)N

InChI

InChI=1S/C27H27N7OS/c1-16-9-10-17(31-25(35)21-11-12-22(36-21)27(2,3)4)13-19(16)33-26-32-18-7-5-6-8-20(18)34(26)24-14-23(28)29-15-30-24/h5-15H,1-4H3,(H,31,35)(H,32,33)(H2,28,29,30)