2-[[4-(4-methoxyphenyl)-5-(2-methylfuran-3-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-(thiophen-2-ylmethyl)ethanamide

Systemtic Name: 2-[[4-(4-methoxyphenyl)-5-(2-methylfuran-3-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-(thiophen-2-ylmethyl)ethanamide Openeye Name: 2-[[4-(4-methoxyphenyl)-5-(2-methyl-3-furyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-thienylmethyl)acetamide CAS Name: 2-[[4-(4-methoxyphenyl)-5-(2-methyl-3-furanyl)-1,2,4-triazol-3-yl]thio]-N-(thiophen-2-ylmethyl)acetamide IUPAC Name: 2-[[4-(4-methoxyphenyl)-5-(2-methylfuran-3-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-(thiophen-2-ylmethyl)acetamide Traditional Name: 2-[[4-(4-methoxyphenyl)-5-(2-methyl-3-furyl)-1,2,4-triazol-3-yl]thio]-N-(2-thenyl)acetamide Formula: C21H20N4O3S2 MolecularWeight: 440.5385

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CO1)C2=NN=C(N2C3=CC=C(C=C3)OC)SCC(=O)NCC4=CC=CS4

Isomeric SMILES

CC1=C(C=CO1)C2=NN=C(N2C3=CC=C(C=C3)OC)SCC(=O)NCC4=CC=CS4

InChI

InChI=1S/C21H20N4O3S2/c1-14-18(9-10-28-14)20-23-24-21(25(20)15-5-7-16(27-2)8-6-15)30-13-19(26)22-12-17-4-3-11-29-17/h3-11H,12-13H2,1-2H3,(H,22,26)