N4-(5-chloranyl-2-methyl-phenyl)-N6-(3-methoxyphenyl)pyrimidine-4,5,6-triamine

Systemtic Name: N4-(5-chloranyl-2-methyl-phenyl)-N6-(3-methoxyphenyl)pyrimidine-4,5,6-triamine Openeye Name: N4-(5-chloro-2-methyl-phenyl)-N6-(3-methoxyphenyl)pyrimidine-4,5,6-triamine CAS Name: N4-(5-chloro-2-methylphenyl)-N6-(3-methoxyphenyl)pyrimidine-4,5,6-triamine IUPAC Name: 4-N-(5-chloro-2-methylphenyl)-6-N-(3-methoxyphenyl)pyrimidine-4,5,6-triamine Traditional Name: [5-amino-6-(5-chloro-2-methyl-anilino)pyrimidin-4-yl]-(3-methoxyphenyl)amine Formula: C18H18ClN5O MolecularWeight: 355.82142

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)NC2=NC=NC(=C2N)NC3=CC(=CC=C3)OC

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)NC2=NC=NC(=C2N)NC3=CC(=CC=C3)OC

InChI

InChI=1S/C18H18ClN5O/c1-11-6-7-12(19)8-15(11)24-18-16(20)17(21-10-22-18)23-13-4-3-5-14(9-13)25-2/h3-10H,20H2,1-2H3,(H2,21,22,23,24)