4-[4-(3,3-dimethylpiperazin-1-yl)phenyl]-5-methyl-quinazoline-2,7-diamine

Systemtic Name: 4-[4-(3,3-dimethylpiperazin-1-yl)phenyl]-5-methyl-quinazoline-2,7-diamine Openeye Name: 4-[4-(3,3-dimethylpiperazin-1-yl)phenyl]-5-methyl-quinazoline-2,7-diamine CAS Name: 4-[4-(3,3-dimethyl-1-piperazinyl)phenyl]-5-methylquinazoline-2,7-diamine IUPAC Name: 4-[4-(3,3-dimethylpiperazin-1-yl)phenyl]-5-methylquinazoline-2,7-diamine Traditional Name: [2-amino-4-[4-(3,3-dimethylpiperazino)phenyl]-5-methyl-quinazolin-7-yl]amine Formula: C21H26N6 MolecularWeight: 362.47134

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC2=C1C(=NC(=N2)N)C3=CC=C(C=C3)N4CCNC(C4)(C)C)N

Isomeric SMILES

CC1=CC(=CC2=C1C(=NC(=N2)N)C3=CC=C(C=C3)N4CCNC(C4)(C)C)N

InChI

InChI=1S/C21H26N6/c1-13-10-15(22)11-17-18(13)19(26-20(23)25-17)14-4-6-16(7-5-14)27-9-8-24-21(2,3)12-27/h4-7,10-11,24H,8-9,12,22H2,1-3H3,(H2,23,25,26)