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

Systemtic Name: 3-[1-(3-azanylpropyl)indol-3-yl]-4-(1-methylindol-3-yl)-1H-1,2,4-triazol-5-one Openeye Name: 3-[1-(3-aminopropyl)indol-3-yl]-4-(1-methylindol-3-yl)-1H-1,2,4-triazol-5-one CAS Name: 3-[1-(3-aminopropyl)-3-indolyl]-4-(1-methyl-3-indolyl)-1H-1,2,4-triazol-5-one IUPAC Name: 3-[1-(3-aminopropyl)indol-3-yl]-4-(1-methylindol-3-yl)-1H-1,2,4-triazol-5-one Traditional Name: 3-[1-(3-aminopropyl)indol-3-yl]-4-(1-methylindol-3-yl)-1H-1,2,4-triazol-5-one Formula: C22H22N6O MolecularWeight: 386.44968

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C2=CC=CC=C21)N3C(=NNC3=O)C4=CN(C5=CC=CC=C54)CCCN

Isomeric SMILES

CN1C=C(C2=CC=CC=C21)N3C(=NNC3=O)C4=CN(C5=CC=CC=C54)CCCN

InChI

InChI=1S/C22H22N6O/c1-26-14-20(16-8-3-4-9-18(16)26)28-21(24-25-22(28)29)17-13-27(12-6-11-23)19-10-5-2-7-15(17)19/h2-5,7-10,13-14H,6,11-12,23H2,1H3,(H,25,29)