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

Systemtic Name: 5-methyl-6-[[(3,4,5-trimethoxyphenyl)amino]methyl]quinazoline-2,4-diamine; 2-oxidanylpropanoate; hydrate Openeye Name: 2-hydroxypropanoate; 5-methyl-6-[(3,4,5-trimethoxyanilino)methyl]quinazoline-2,4-diamine; hydrate CAS Name: 2-hydroxypropanoate; 5-methyl-6-[(3,4,5-trimethoxyanilino)methyl]quinazoline-2,4-diamine; hydrate IUPAC Name: 2-hydroxypropanoate; 5-methyl-6-[(3,4,5-trimethoxyanilino)methyl]quinazoline-2,4-diamine; hydrate Traditional Name: (2,4-diamino-5-methyl-quinazolin-6-yl)methyl-(3,4,5-trimethoxyphenyl)amine; lactate; hydrate Formula: C22H30N5O7- MolecularWeight: 476.5029

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1C(=NC(=N2)N)N)CNC3=CC(=C(C(=C3)OC)OC)OC.CC(C(=O)[O-])O.O

Isomeric SMILES

CC1=C(C=CC2=C1C(=NC(=N2)N)N)CNC3=CC(=C(C(=C3)OC)OC)OC.CC(C(=O)[O-])O.O

InChI

InChI=1S/C19H23N5O3.C3H6O3.H2O/c1-10-11(5-6-13-16(10)18(20)24-19(21)23-13)9-22-12-7-14(25-2)17(27-4)15(8-12)26-3;1-2(4)3(5)6;/h5-8,22H,9H2,1-4H3,(H4,20,21,23,24);2,4H,1H3,(H,5,6);1H2/p-1