2-[[2-(2,4-dimethylphenyl)-5-methyl-1,2,3-triazol-4-yl]carbonyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide

Systemtic Name: 2-[[2-(2,4-dimethylphenyl)-5-methyl-1,2,3-triazol-4-yl]carbonyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide Openeye Name: 2-[2-(2,4-dimethylphenyl)-5-methyl-triazole-4-carbonyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide CAS Name: 2-[[2-(2,4-dimethylphenyl)-5-methyl-4-triazolyl]-oxomethyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide IUPAC Name: 2-[2-(2,4-dimethylphenyl)-5-methyltriazole-4-carbonyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide Traditional Name: 2-[2-(2,4-dimethylphenyl)-5-methyl-triazole-4-carbonyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide Formula: C22H23N5O2 MolecularWeight: 389.45032

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N2N=C(C(=N2)C(=O)N3CC4=CC=CC=C4CC3C(=O)N)C)C

Isomeric SMILES

CC1=CC(=C(C=C1)N2N=C(C(=N2)C(=O)N3CC4=CC=CC=C4CC3C(=O)N)C)C

InChI

InChI=1S/C22H23N5O2/c1-13-8-9-18(14(2)10-13)27-24-15(3)20(25-27)22(29)26-12-17-7-5-4-6-16(17)11-19(26)21(23)28/h4-10,19H,11-12H2,1-3H3,(H2,23,28)