N-(2-hydroxyphenyl)-2-[[5-(2-methylphenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]propanamide

Systemtic Name: N-(2-hydroxyphenyl)-2-[[5-(2-methylphenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]propanamide Openeye Name: 2-[[4-allyl-5-(o-tolyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-hydroxyphenyl)propanamide CAS Name: N-(2-hydroxyphenyl)-2-[[5-(2-methylphenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]thio]propanamide IUPAC Name: N-(2-hydroxyphenyl)-2-[[5-(2-methylphenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]propanamide Traditional Name: 2-[[4-allyl-5-(o-tolyl)-1,2,4-triazol-3-yl]thio]-N-(2-hydroxyphenyl)propionamide Formula: C21H22N4O2S MolecularWeight: 394.48998

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=NN=C(N2CC=C)SC(C)C(=O)NC3=CC=CC=C3O

Isomeric SMILES

CC1=CC=CC=C1C2=NN=C(N2CC=C)SC(C)C(=O)NC3=CC=CC=C3O

InChI

InChI=1S/C21H22N4O2S/c1-4-13-25-19(16-10-6-5-9-14(16)2)23-24-21(25)28-15(3)20(27)22-17-11-7-8-12-18(17)26/h4-12,15,26H,1,13H2,2-3H3,(H,22,27)