3-(4-bromophenyl)-N1-[6-(3-methyl-2H-indazol-5-yl)pyrazin-2-yl]propane-1,2-diamine

Systemtic Name: 3-(4-bromophenyl)-N1-[6-(3-methyl-2H-indazol-5-yl)pyrazin-2-yl]propane-1,2-diamine Openeye Name: 3-(4-bromophenyl)-N1-[6-(3-methyl-2H-indazol-5-yl)pyrazin-2-yl]propane-1,2-diamine CAS Name: 3-(4-bromophenyl)-N1-[6-(3-methyl-2H-indazol-5-yl)-2-pyrazinyl]propane-1,2-diamine IUPAC Name: 3-(4-bromophenyl)-1-N-[6-(3-methyl-2H-indazol-5-yl)pyrazin-2-yl]propane-1,2-diamine Traditional Name: [2-amino-3-(4-bromophenyl)propyl]-[6-(3-methyl-2H-indazol-5-yl)pyrazin-2-yl]amine Formula: C21H21BrN6 MolecularWeight: 437.33564

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C=C(C=CC2=NN1)C3=CN=CC(=N3)NCC(CC4=CC=C(C=C4)Br)N

Isomeric SMILES

CC1=C2C=C(C=CC2=NN1)C3=CN=CC(=N3)NCC(CC4=CC=C(C=C4)Br)N

InChI

InChI=1S/C21H21BrN6/c1-13-18-9-15(4-7-19(18)28-27-13)20-11-24-12-21(26-20)25-10-17(23)8-14-2-5-16(22)6-3-14/h2-7,9,11-12,17H,8,10,23H2,1H3,(H,25,26)(H,27,28)