N2-[4-(aminomethyl)phenyl]-5-bromanyl-N4-(5-cyclopropyl-1H-pyrazol-3-yl)pyrimidine-2,4-diamine

Systemtic Name: N2-[4-(aminomethyl)phenyl]-5-bromanyl-N4-(5-cyclopropyl-1H-pyrazol-3-yl)pyrimidine-2,4-diamine Openeye Name: N2-[4-(aminomethyl)phenyl]-5-bromo-N4-(5-cyclopropyl-1H-pyrazol-3-yl)pyrimidine-2,4-diamine CAS Name: N2-[4-(aminomethyl)phenyl]-5-bromo-N4-(5-cyclopropyl-1H-pyrazol-3-yl)pyrimidine-2,4-diamine IUPAC Name: 2-N-[4-(aminomethyl)phenyl]-5-bromo-4-N-(5-cyclopropyl-1H-pyrazol-3-yl)pyrimidine-2,4-diamine Traditional Name: [2-[4-(aminomethyl)anilino]-5-bromo-pyrimidin-4-yl]-(5-cyclopropyl-1H-pyrazol-3-yl)amine Formula: C17H18BrN7 MolecularWeight: 400.27572

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=CC(=NN2)NC3=NC(=NC=C3Br)NC4=CC=C(C=C4)CN

Isomeric SMILES

C1CC1C2=CC(=NN2)NC3=NC(=NC=C3Br)NC4=CC=C(C=C4)CN

InChI

InChI=1S/C17H18BrN7/c18-13-9-20-17(21-12-5-1-10(8-19)2-6-12)23-16(13)22-15-7-14(24-25-15)11-3-4-11/h1-2,5-7,9,11H,3-4,8,19H2,(H3,20,21,22,23,24,25)