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

Systemtic Name: 5-[[(3,4,5-trimethoxyphenyl)amino]methyl]quinazoline-2,4-diamine Openeye Name: 5-[(3,4,5-trimethoxyanilino)methyl]quinazoline-2,4-diamine CAS Name: 5-[(3,4,5-trimethoxyanilino)methyl]quinazoline-2,4-diamine IUPAC Name: 5-[(3,4,5-trimethoxyanilino)methyl]quinazoline-2,4-diamine Traditional Name: (2,4-diaminoquinazolin-5-yl)methyl-(3,4,5-trimethoxyphenyl)amine Formula: C18H21N5O3 MolecularWeight: 355.39104

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)NCC2=C3C(=CC=C2)N=C(N=C3N)N

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)NCC2=C3C(=CC=C2)N=C(N=C3N)N

InChI

InChI=1S/C18H21N5O3/c1-24-13-7-11(8-14(25-2)16(13)26-3)21-9-10-5-4-6-12-15(10)17(19)23-18(20)22-12/h4-8,21H,9H2,1-3H3,(H4,19,20,22,23)