N-(2-methoxyethyl)-4-[[5-(4-methylphenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanylmethyl]benzamide

Systemtic Name: N-(2-methoxyethyl)-4-[[5-(4-methylphenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanylmethyl]benzamide Openeye Name: 4-[[4-allyl-5-(p-tolyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-N-(2-methoxyethyl)benzamide CAS Name: N-(2-methoxyethyl)-4-[[[5-(4-methylphenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]thio]methyl]benzamide IUPAC Name: N-(2-methoxyethyl)-4-[[5-(4-methylphenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanylmethyl]benzamide Traditional Name: 4-[[[4-allyl-5-(p-tolyl)-1,2,4-triazol-3-yl]thio]methyl]-N-(2-methoxyethyl)benzamide Formula: C23H26N4O2S MolecularWeight: 422.54314

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN=C(N2CC=C)SCC3=CC=C(C=C3)C(=O)NCCOC

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN=C(N2CC=C)SCC3=CC=C(C=C3)C(=O)NCCOC

InChI

InChI=1S/C23H26N4O2S/c1-4-14-27-21(19-9-5-17(2)6-10-19)25-26-23(27)30-16-18-7-11-20(12-8-18)22(28)24-13-15-29-3/h4-12H,1,13-16H2,2-3H3,(H,24,28)