N4-(3-bromophenyl)-5-chloranyl-N7-(2-dimethylaminoethyl)quinazoline-4,6,7-triamine

Systemtic Name: N4-(3-bromophenyl)-5-chloranyl-N7-(2-dimethylaminoethyl)quinazoline-4,6,7-triamine Openeye Name: N4-(3-bromophenyl)-5-chloro-N7-(2-dimethylaminoethyl)quinazoline-4,6,7-triamine CAS Name: N4-(3-bromophenyl)-5-chloro-N7-(2-dimethylaminoethyl)quinazoline-4,6,7-triamine IUPAC Name: 4-N-(3-bromophenyl)-5-chloro-7-N-(2-dimethylaminoethyl)quinazoline-4,6,7-triamine Traditional Name: 2-[[6-amino-4-(3-bromoanilino)-5-chloro-quinazolin-7-yl]amino]ethyl-dimethyl-amine Formula: C18H20BrClN6 MolecularWeight: 435.7486

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCNC1=C(C(=C2C(=C1)N=CN=C2NC3=CC(=CC=C3)Br)Cl)N

Isomeric SMILES

CN(C)CCNC1=C(C(=C2C(=C1)N=CN=C2NC3=CC(=CC=C3)Br)Cl)N

InChI

InChI=1S/C18H20BrClN6/c1-26(2)7-6-22-14-9-13-15(16(20)17(14)21)18(24-10-23-13)25-12-5-3-4-11(19)8-12/h3-5,8-10,22H,6-7,21H2,1-2H3,(H,23,24,25)