2-[3-[5-azanyl-2-(2-azanyl-5-cyano-phenoxy)-6-[(phenylmethyl)amino]pyrimidin-4-yl]oxyphenyl]guanidine

Systemtic Name: 2-[3-[5-azanyl-2-(2-azanyl-5-cyano-phenoxy)-6-[(phenylmethyl)amino]pyrimidin-4-yl]oxyphenyl]guanidine Openeye Name: 2-[3-[5-amino-2-(2-amino-5-cyano-phenoxy)-6-(benzylamino)pyrimidin-4-yl]oxyphenyl]guanidine CAS Name: 2-[3-[[5-amino-2-(2-amino-5-cyanophenoxy)-6-[(phenylmethyl)amino]-4-pyrimidinyl]oxy]phenyl]guanidine IUPAC Name: 2-[3-[5-amino-2-(2-amino-5-cyanophenoxy)-6-(benzylamino)pyrimidin-4-yl]oxyphenyl]guanidine Traditional Name: 2-[3-[5-amino-2-(2-amino-5-cyano-phenoxy)-6-(benzylamino)pyrimidin-4-yl]oxyphenyl]guanidine Formula: C25H23N9O2 MolecularWeight: 481.50922

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC2=C(C(=NC(=N2)OC3=C(C=CC(=C3)C#N)N)OC4=CC=CC(=C4)N=C(N)N)N

Isomeric SMILES

C1=CC=C(C=C1)CNC2=C(C(=NC(=N2)OC3=C(C=CC(=C3)C#N)N)OC4=CC=CC(=C4)N=C(N)N)N

InChI

InChI=1S/C25H23N9O2/c26-13-16-9-10-19(27)20(11-16)36-25-33-22(31-14-15-5-2-1-3-6-15)21(28)23(34-25)35-18-8-4-7-17(12-18)32-24(29)30/h1-12H,14,27-28H2,(H4,29,30,32)(H,31,33,34)