5-chloranyl-N6,N6-bis(phenylmethyl)quinazoline-2,4,6-triamine hydrochloride

Systemtic Name: 5-chloranyl-N6,N6-bis(phenylmethyl)quinazoline-2,4,6-triamine hydrochloride Openeye Name: N6,N6-dibenzyl-5-chloro-quinazoline-2,4,6-triamine hydrochloride CAS Name: 5-chloro-N6,N6-bis(phenylmethyl)quinazoline-2,4,6-triamine hydrochloride IUPAC Name: 6-N,6-N-dibenzyl-5-chloroquinazoline-2,4,6-triamine hydrochloride Traditional Name: dibenzyl-(2,4-diamino-5-chloro-quinazolin-6-yl)amine hydrochloride Formula: C22H21Cl2N5 MolecularWeight: 426.34164

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN(CC2=CC=CC=C2)C3=C(C4=C(C=C3)N=C(N=C4N)N)Cl.Cl

Isomeric SMILES

C1=CC=C(C=C1)CN(CC2=CC=CC=C2)C3=C(C4=C(C=C3)N=C(N=C4N)N)Cl.Cl

InChI

InChI=1S/C22H20ClN5.ClH/c23-20-18(12-11-17-19(20)21(24)27-22(25)26-17)28(13-15-7-3-1-4-8-15)14-16-9-5-2-6-10-16;/h1-12H,13-14H2,(H4,24,25,26,27);1H