5-azanyl-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-[(2-methylphenyl)methyl]-1,2,3-triazole-4-carboxamide

Systemtic Name: 5-azanyl-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-[(2-methylphenyl)methyl]-1,2,3-triazole-4-carboxamide Openeye Name: 5-amino-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-(o-tolylmethyl)triazole-4-carboxamide CAS Name: 5-amino-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-[(2-methylphenyl)methyl]-4-triazolecarboxamide IUPAC Name: 5-amino-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-[(2-methylphenyl)methyl]triazole-4-carboxamide Traditional Name: 5-amino-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-(2-methylbenzyl)triazole-4-carboxamide Formula: C19H19N5O3 MolecularWeight: 365.38586

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN2C(=C(N=N2)C(=O)NC3=CC4=C(C=C3)OCCO4)N

Isomeric SMILES

CC1=CC=CC=C1CN2C(=C(N=N2)C(=O)NC3=CC4=C(C=C3)OCCO4)N

InChI

InChI=1S/C19H19N5O3/c1-12-4-2-3-5-13(12)11-24-18(20)17(22-23-24)19(25)21-14-6-7-15-16(10-14)27-9-8-26-15/h2-7,10H,8-9,11,20H2,1H3,(H,21,25)