8-[(4-bromophenyl)methylamino]-1-methyl-4,5-dihydropyrazolo[4,3-h]quinazoline-3-carboxamide

Systemtic Name: 8-[(4-bromophenyl)methylamino]-1-methyl-4,5-dihydropyrazolo[4,3-h]quinazoline-3-carboxamide Openeye Name: 8-[(4-bromophenyl)methylamino]-1-methyl-4,5-dihydropyrazolo[4,3-h]quinazoline-3-carboxamide CAS Name: 8-[(4-bromophenyl)methylamino]-1-methyl-4,5-dihydropyrazolo[4,3-h]quinazoline-3-carboxamide IUPAC Name: 8-[(4-bromophenyl)methylamino]-1-methyl-4,5-dihydropyrazolo[4,3-h]quinazoline-3-carboxamide Traditional Name: 8-[(4-bromobenzyl)amino]-1-methyl-4,5-dihydropyrazolo[4,3-h]quinazoline-3-carboxamide Formula: C18H17BrN6O MolecularWeight: 413.27118

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(CCC3=CN=C(N=C32)NCC4=CC=C(C=C4)Br)C(=N1)C(=O)N

Isomeric SMILES

CN1C2=C(CCC3=CN=C(N=C32)NCC4=CC=C(C=C4)Br)C(=N1)C(=O)N

InChI

InChI=1S/C18H17BrN6O/c1-25-16-13(15(24-25)17(20)26)7-4-11-9-22-18(23-14(11)16)21-8-10-2-5-12(19)6-3-10/h2-3,5-6,9H,4,7-8H2,1H3,(H2,20,26)(H,21,22,23)