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

Systemtic Name: 6-[[(3-bromophenyl)amino]methyl]-5-methyl-quinazoline-2,4-diamine Openeye Name: 6-[(3-bromoanilino)methyl]-5-methyl-quinazoline-2,4-diamine CAS Name: 6-[(3-bromoanilino)methyl]-5-methylquinazoline-2,4-diamine IUPAC Name: 6-[(3-bromoanilino)methyl]-5-methylquinazoline-2,4-diamine Traditional Name: (3-bromophenyl)-[(2,4-diamino-5-methyl-quinazolin-6-yl)methyl]amine Formula: C16H16BrN5 MolecularWeight: 358.23574

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1C(=NC(=N2)N)N)CNC3=CC(=CC=C3)Br

Isomeric SMILES

CC1=C(C=CC2=C1C(=NC(=N2)N)N)CNC3=CC(=CC=C3)Br

InChI

InChI=1S/C16H16BrN5/c1-9-10(8-20-12-4-2-3-11(17)7-12)5-6-13-14(9)15(18)22-16(19)21-13/h2-7,20H,8H2,1H3,(H4,18,19,21,22)