2-[2-[[4-methyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanoylamino]-5-phenyl-thiophene-3-carboxamide

Systemtic Name: 2-[2-[[4-methyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanoylamino]-5-phenyl-thiophene-3-carboxamide Openeye Name: 2-[[2-[[4-methyl-5-(2-thienylmethyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]-5-phenyl-thiophene-3-carboxamide CAS Name: 2-[[2-[[4-methyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]thio]-1-oxoethyl]amino]-5-phenyl-3-thiophenecarboxamide IUPAC Name: 2-[[2-[[4-methyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]-5-phenylthiophene-3-carboxamide Traditional Name: 2-[[2-[[4-methyl-5-(2-thenyl)-1,2,4-triazol-3-yl]thio]acetyl]amino]-5-phenyl-thiophene-3-carboxamide Formula: C21H19N5O2S3 MolecularWeight: 469.60286

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC(=O)NC2=C(C=C(S2)C3=CC=CC=C3)C(=O)N)CC4=CC=CS4

Isomeric SMILES

CN1C(=NN=C1SCC(=O)NC2=C(C=C(S2)C3=CC=CC=C3)C(=O)N)CC4=CC=CS4

InChI

InChI=1S/C21H19N5O2S3/c1-26-17(10-14-8-5-9-29-14)24-25-21(26)30-12-18(27)23-20-15(19(22)28)11-16(31-20)13-6-3-2-4-7-13/h2-9,11H,10,12H2,1H3,(H2,22,28)(H,23,27)