N-[(4-methylphenyl)-thiophen-2-yl-methyl]-2-[(5-methyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]ethanamide

Systemtic Name: N-[(4-methylphenyl)-thiophen-2-yl-methyl]-2-[(5-methyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: 2-[(4-allyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-[p-tolyl(2-thienyl)methyl]acetamide CAS Name: N-[(4-methylphenyl)-thiophen-2-ylmethyl]-2-[(5-methyl-4-prop-2-enyl-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-[(4-methylphenyl)-thiophen-2-ylmethyl]-2-[(5-methyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: 2-[(4-allyl-5-methyl-1,2,4-triazol-3-yl)thio]-N-[p-tolyl(2-thienyl)methyl]acetamide Formula: C20H22N4OS2 MolecularWeight: 398.54488

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C2=CC=CS2)NC(=O)CSC3=NN=C(N3CC=C)C

Isomeric SMILES

CC1=CC=C(C=C1)C(C2=CC=CS2)NC(=O)CSC3=NN=C(N3CC=C)C

InChI

InChI=1S/C20H22N4OS2/c1-4-11-24-15(3)22-23-20(24)27-13-18(25)21-19(17-6-5-12-26-17)16-9-7-14(2)8-10-16/h4-10,12,19H,1,11,13H2,2-3H3,(H,21,25)