5-[(E)-methoxyiminomethyl]-N4-[1-[(3-methoxyphenyl)methyl]indazol-5-yl]pyrimidine-4,6-diamine

Systemtic Name: 5-[(E)-methoxyiminomethyl]-N4-[1-[(3-methoxyphenyl)methyl]indazol-5-yl]pyrimidine-4,6-diamine Openeye Name: 5-[(E)-methoxyiminomethyl]-N4-[1-[(3-methoxyphenyl)methyl]indazol-5-yl]pyrimidine-4,6-diamine CAS Name: 5-[(E)-methoxyiminomethyl]-N4-[1-[(3-methoxyphenyl)methyl]-5-indazolyl]pyrimidine-4,6-diamine IUPAC Name: 5-[(E)-methoxyiminomethyl]-4-N-[1-[(3-methoxyphenyl)methyl]indazol-5-yl]pyrimidine-4,6-diamine Traditional Name: [6-amino-5-[(E)-methyloximinomethyl]pyrimidin-4-yl]-(1-m-anisylindazol-5-yl)amine Formula: C21H21N7O2 MolecularWeight: 403.43714

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CN2C3=C(C=C(C=C3)NC4=NC=NC(=C4C=NOC)N)C=N2

Isomeric SMILES

COC1=CC=CC(=C1)CN2C3=C(C=C(C=C3)NC4=NC=NC(=C4/C=N/OC)N)C=N2

InChI

InChI=1S/C21H21N7O2/c1-29-17-5-3-4-14(8-17)12-28-19-7-6-16(9-15(19)10-25-28)27-21-18(11-26-30-2)20(22)23-13-24-21/h3-11,13H,12H2,1-2H3,(H3,22,23,24,27)/b26-11+