3-(3,3-dimethyl-2-pyridin-4-yl-indol-5-yl)-4-methyl-1H-1,2,4-triazol-5-one

Systemtic Name: 3-(3,3-dimethyl-2-pyridin-4-yl-indol-5-yl)-4-methyl-1H-1,2,4-triazol-5-one Openeye Name: 3-[3,3-dimethyl-2-(4-pyridyl)indol-5-yl]-4-methyl-1H-1,2,4-triazol-5-one CAS Name: 3-(3,3-dimethyl-2-pyridin-4-yl-5-indolyl)-4-methyl-1H-1,2,4-triazol-5-one IUPAC Name: 3-(3,3-dimethyl-2-pyridin-4-ylindol-5-yl)-4-methyl-1H-1,2,4-triazol-5-one Traditional Name: 3-[3,3-dimethyl-2-(4-pyridyl)indol-5-yl]-4-methyl-1H-1,2,4-triazol-5-one Formula: C18H17N5O MolecularWeight: 319.36048

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=C(C=CC(=C2)C3=NNC(=O)N3C)N=C1C4=CC=NC=C4)C

Isomeric SMILES

CC1(C2=C(C=CC(=C2)C3=NNC(=O)N3C)N=C1C4=CC=NC=C4)C

InChI

InChI=1S/C18H17N5O/c1-18(2)13-10-12(16-21-22-17(24)23(16)3)4-5-14(13)20-15(18)11-6-8-19-9-7-11/h4-10H,1-3H3,(H,22,24)