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

Systemtic Name: 4-[(3-methylphenoxy)methyl]-N-[1-(phenylmethyl)-1,2,4-triazol-3-yl]thiophene-2-carboxamide Openeye Name: N-(1-benzyl-1,2,4-triazol-3-yl)-4-[(3-methylphenoxy)methyl]thiophene-2-carboxamide CAS Name: 4-[(3-methylphenoxy)methyl]-N-[1-(phenylmethyl)-1,2,4-triazol-3-yl]-2-thiophenecarboxamide IUPAC Name: N-(1-benzyl-1,2,4-triazol-3-yl)-4-[(3-methylphenoxy)methyl]thiophene-2-carboxamide Traditional Name: N-(1-benzyl-1,2,4-triazol-3-yl)-4-[(3-methylphenoxy)methyl]thiophene-2-carboxamide Formula: C22H20N4O2S MolecularWeight: 404.4848

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCC2=CSC(=C2)C(=O)NC3=NN(C=N3)CC4=CC=CC=C4

Isomeric SMILES

CC1=CC(=CC=C1)OCC2=CSC(=C2)C(=O)NC3=NN(C=N3)CC4=CC=CC=C4

InChI

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