N2-(4-chloranyl-3-methyl-phenyl)-N4-(5-cyclopropyl-1H-pyrazol-3-yl)quinazoline-2,4-diamine

Systemtic Name: N2-(4-chloranyl-3-methyl-phenyl)-N4-(5-cyclopropyl-1H-pyrazol-3-yl)quinazoline-2,4-diamine Openeye Name: N2-(4-chloro-3-methyl-phenyl)-N4-(5-cyclopropyl-1H-pyrazol-3-yl)quinazoline-2,4-diamine CAS Name: N2-(4-chloro-3-methylphenyl)-N4-(5-cyclopropyl-1H-pyrazol-3-yl)quinazoline-2,4-diamine IUPAC Name: 2-N-(4-chloro-3-methylphenyl)-4-N-(5-cyclopropyl-1H-pyrazol-3-yl)quinazoline-2,4-diamine Traditional Name: [2-(4-chloro-3-methyl-anilino)quinazolin-4-yl]-(5-cyclopropyl-1H-pyrazol-3-yl)amine Formula: C21H19ClN6 MolecularWeight: 390.86876

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC2=NC3=CC=CC=C3C(=N2)NC4=NNC(=C4)C5CC5)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)NC2=NC3=CC=CC=C3C(=N2)NC4=NNC(=C4)C5CC5)Cl

InChI

InChI=1S/C21H19ClN6/c1-12-10-14(8-9-16(12)22)23-21-24-17-5-3-2-4-15(17)20(26-21)25-19-11-18(27-28-19)13-6-7-13/h2-5,8-11,13H,6-7H2,1H3,(H3,23,24,25,26,27,28)