2-[[2-[(4-methoxyphenyl)methyl]-1,2,4-triazol-3-yl]methyl]-3,4-dihydro-1H-isoquinoline-6-carboxamide

Systemtic Name: 2-[[2-[(4-methoxyphenyl)methyl]-1,2,4-triazol-3-yl]methyl]-3,4-dihydro-1H-isoquinoline-6-carboxamide Openeye Name: 2-[[2-[(4-methoxyphenyl)methyl]-1,2,4-triazol-3-yl]methyl]-3,4-dihydro-1H-isoquinoline-6-carboxamide CAS Name: 2-[[2-[(4-methoxyphenyl)methyl]-1,2,4-triazol-3-yl]methyl]-3,4-dihydro-1H-isoquinoline-6-carboxamide IUPAC Name: 2-[[2-[(4-methoxyphenyl)methyl]-1,2,4-triazol-3-yl]methyl]-3,4-dihydro-1H-isoquinoline-6-carboxamide Traditional Name: 2-[(2-p-anisyl-1,2,4-triazol-3-yl)methyl]-3,4-dihydro-1H-isoquinoline-6-carboxamide Formula: C21H23N5O2 MolecularWeight: 377.43962

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN2C(=NC=N2)CN3CCC4=C(C3)C=CC(=C4)C(=O)N

Isomeric SMILES

COC1=CC=C(C=C1)CN2C(=NC=N2)CN3CCC4=C(C3)C=CC(=C4)C(=O)N

InChI

InChI=1S/C21H23N5O2/c1-28-19-6-2-15(3-7-19)11-26-20(23-14-24-26)13-25-9-8-16-10-17(21(22)27)4-5-18(16)12-25/h2-7,10,14H,8-9,11-13H2,1H3,(H2,22,27)