5-chloranyl-N6-[(2,5-dimethoxyphenyl)methyl]quinazoline-2,4,6-triamine

Systemtic Name: 5-chloranyl-N6-[(2,5-dimethoxyphenyl)methyl]quinazoline-2,4,6-triamine Openeye Name: 5-chloro-N6-[(2,5-dimethoxyphenyl)methyl]quinazoline-2,4,6-triamine CAS Name: 5-chloro-N6-[(2,5-dimethoxyphenyl)methyl]quinazoline-2,4,6-triamine IUPAC Name: 5-chloro-6-N-[(2,5-dimethoxyphenyl)methyl]quinazoline-2,4,6-triamine Traditional Name: (2,4-diamino-5-chloro-quinazolin-6-yl)-(2,5-dimethoxybenzyl)amine Formula: C17H18ClN5O2 MolecularWeight: 359.81012

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)CNC2=C(C3=C(C=C2)N=C(N=C3N)N)Cl

Isomeric SMILES

COC1=CC(=C(C=C1)OC)CNC2=C(C3=C(C=C2)N=C(N=C3N)N)Cl

InChI

InChI=1S/C17H18ClN5O2/c1-24-10-3-6-13(25-2)9(7-10)8-21-12-5-4-11-14(15(12)18)16(19)23-17(20)22-11/h3-7,21H,8H2,1-2H3,(H4,19,20,22,23)