N-[1-[(4-methylphenyl)methyl]-1,2,4-triazol-3-yl]-4-(phenoxymethyl)thiophene-2-carboxamide

Systemtic Name: N-[1-[(4-methylphenyl)methyl]-1,2,4-triazol-3-yl]-4-(phenoxymethyl)thiophene-2-carboxamide Openeye Name: 4-(phenoxymethyl)-N-[1-(p-tolylmethyl)-1,2,4-triazol-3-yl]thiophene-2-carboxamide CAS Name: N-[1-[(4-methylphenyl)methyl]-1,2,4-triazol-3-yl]-4-(phenoxymethyl)-2-thiophenecarboxamide IUPAC Name: N-[1-[(4-methylphenyl)methyl]-1,2,4-triazol-3-yl]-4-(phenoxymethyl)thiophene-2-carboxamide Traditional Name: N-[1-(4-methylbenzyl)-1,2,4-triazol-3-yl]-4-(phenoxymethyl)thiophene-2-carboxamide Formula: C22H20N4O2S MolecularWeight: 404.4848

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C=NC(=N2)NC(=O)C3=CC(=CS3)COC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)CN2C=NC(=N2)NC(=O)C3=CC(=CS3)COC4=CC=CC=C4

InChI

InChI=1S/C22H20N4O2S/c1-16-7-9-17(10-8-16)12-26-15-23-22(25-26)24-21(27)20-11-18(14-29-20)13-28-19-5-3-2-4-6-19/h2-11,14-15H,12-13H2,1H3,(H,24,25,27)