4-[1-(3-azanylpropyl)-6-methyl-indol-3-yl]-3-(1-methylindol-3-yl)-1H-1,2,4-triazol-5-one

Systemtic Name: 4-[1-(3-azanylpropyl)-6-methyl-indol-3-yl]-3-(1-methylindol-3-yl)-1H-1,2,4-triazol-5-one Openeye Name: 4-[1-(3-aminopropyl)-6-methyl-indol-3-yl]-3-(1-methylindol-3-yl)-1H-1,2,4-triazol-5-one CAS Name: 4-[1-(3-aminopropyl)-6-methyl-3-indolyl]-3-(1-methyl-3-indolyl)-1H-1,2,4-triazol-5-one IUPAC Name: 4-[1-(3-aminopropyl)-6-methylindol-3-yl]-3-(1-methylindol-3-yl)-1H-1,2,4-triazol-5-one Traditional Name: 4-[1-(3-aminopropyl)-6-methyl-indol-3-yl]-3-(1-methylindol-3-yl)-1H-1,2,4-triazol-5-one Formula: C23H24N6O MolecularWeight: 400.47626

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=CN2CCCN)N3C(=NNC3=O)C4=CN(C5=CC=CC=C54)C

Isomeric SMILES

CC1=CC2=C(C=C1)C(=CN2CCCN)N3C(=NNC3=O)C4=CN(C5=CC=CC=C54)C

InChI

InChI=1S/C23H24N6O/c1-15-8-9-17-20(12-15)28(11-5-10-24)14-21(17)29-22(25-26-23(29)30)18-13-27(2)19-7-4-3-6-16(18)19/h3-4,6-9,12-14H,5,10-11,24H2,1-2H3,(H,26,30)