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

Systemtic Name: ethanoic acid; 5-[[(3,4,5-trimethoxyphenyl)amino]methyl]quinazoline-2,4-diamine Openeye Name: acetic acid; 5-[(3,4,5-trimethoxyanilino)methyl]quinazoline-2,4-diamine CAS Name: acetic acid; 5-[(3,4,5-trimethoxyanilino)methyl]quinazoline-2,4-diamine IUPAC Name: acetic acid; 5-[(3,4,5-trimethoxyanilino)methyl]quinazoline-2,4-diamine Traditional Name: acetic acid; (2,4-diaminoquinazolin-5-yl)methyl-(3,4,5-trimethoxyphenyl)amine Formula: C20H25N5O5 MolecularWeight: 415.443

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H21N5O3.C2H4O2/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;1-2(3)4/h4-8,21H,9H2,1-3H3,(H4,19,20,22,23);1H3,(H,3,4)