5-chloranyl-6-[[(3,4,5-trimethoxyphenyl)amino]methyl]quinazoline-2,4-diamine

Systemtic Name: 5-chloranyl-6-[[(3,4,5-trimethoxyphenyl)amino]methyl]quinazoline-2,4-diamine Openeye Name: 5-chloro-6-[(3,4,5-trimethoxyanilino)methyl]quinazoline-2,4-diamine CAS Name: 5-chloro-6-[(3,4,5-trimethoxyanilino)methyl]quinazoline-2,4-diamine IUPAC Name: 5-chloro-6-[(3,4,5-trimethoxyanilino)methyl]quinazoline-2,4-diamine Traditional Name: (2,4-diamino-5-chloro-quinazolin-6-yl)methyl-(3,4,5-trimethoxyphenyl)amine Formula: C18H20ClN5O3 MolecularWeight: 389.8361

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)NCC2=C(C3=C(C=C2)N=C(N=C3N)N)Cl

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)NCC2=C(C3=C(C=C2)N=C(N=C3N)N)Cl

InChI

InChI=1S/C18H20ClN5O3/c1-25-12-6-10(7-13(26-2)16(12)27-3)22-8-9-4-5-11-14(15(9)19)17(20)24-18(21)23-11/h4-7,22H,8H2,1-3H3,(H4,20,21,23,24)