N2-[1-(phenylmethyl)indazol-5-yl]-N4-(3,4,5-trimethoxyphenyl)pyrimidine-2,4-diamine

Systemtic Name: N2-[1-(phenylmethyl)indazol-5-yl]-N4-(3,4,5-trimethoxyphenyl)pyrimidine-2,4-diamine Openeye Name: N2-(1-benzylindazol-5-yl)-N4-(3,4,5-trimethoxyphenyl)pyrimidine-2,4-diamine CAS Name: N2-[1-(phenylmethyl)-5-indazolyl]-N4-(3,4,5-trimethoxyphenyl)pyrimidine-2,4-diamine IUPAC Name: 2-N-(1-benzylindazol-5-yl)-4-N-(3,4,5-trimethoxyphenyl)pyrimidine-2,4-diamine Traditional Name: (1-benzylindazol-5-yl)-[4-(3,4,5-trimethoxyanilino)pyrimidin-2-yl]amine Formula: C27H26N6O3 MolecularWeight: 482.53374

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)NC2=NC(=NC=C2)NC3=CC4=C(C=C3)N(N=C4)CC5=CC=CC=C5

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)NC2=NC(=NC=C2)NC3=CC4=C(C=C3)N(N=C4)CC5=CC=CC=C5

InChI

InChI=1S/C27H26N6O3/c1-34-23-14-21(15-24(35-2)26(23)36-3)30-25-11-12-28-27(32-25)31-20-9-10-22-19(13-20)16-29-33(22)17-18-7-5-4-6-8-18/h4-16H,17H2,1-3H3,(H2,28,30,31,32)