2-[2-[[4-azanyl-5-(2-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]ethanoylamino]-5-phenyl-thiophene-3-carboxamide

Systemtic Name: 2-[2-[[4-azanyl-5-(2-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]ethanoylamino]-5-phenyl-thiophene-3-carboxamide Openeye Name: 2-[[2-[[4-amino-5-(2-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]-5-phenyl-thiophene-3-carboxamide CAS Name: 2-[[2-[[4-amino-5-(2-methoxyphenyl)-1,2,4-triazol-3-yl]thio]-1-oxoethyl]amino]-5-phenyl-3-thiophenecarboxamide IUPAC Name: 2-[[2-[[4-amino-5-(2-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]-5-phenylthiophene-3-carboxamide Traditional Name: 2-[[2-[[4-amino-5-(2-methoxyphenyl)-1,2,4-triazol-3-yl]thio]acetyl]amino]-5-phenyl-thiophene-3-carboxamide Formula: C22H20N6O3S2 MolecularWeight: 480.5626

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C2=NN=C(N2N)SCC(=O)NC3=C(C=C(S3)C4=CC=CC=C4)C(=O)N

Isomeric SMILES

COC1=CC=CC=C1C2=NN=C(N2N)SCC(=O)NC3=C(C=C(S3)C4=CC=CC=C4)C(=O)N

InChI

InChI=1S/C22H20N6O3S2/c1-31-16-10-6-5-9-14(16)20-26-27-22(28(20)24)32-12-18(29)25-21-15(19(23)30)11-17(33-21)13-7-3-2-4-8-13/h2-11H,12,24H2,1H3,(H2,23,30)(H,25,29)