N-ethoxy-2-[[4-(2-methoxyphenyl)-5-pyridin-3-yl-1,2,4-triazol-3-yl]sulfanylmethyl]-1,3-thiazole-4-carboxamide

Systemtic Name: N-ethoxy-2-[[4-(2-methoxyphenyl)-5-pyridin-3-yl-1,2,4-triazol-3-yl]sulfanylmethyl]-1,3-thiazole-4-carboxamide Openeye Name: N-ethoxy-2-[[4-(2-methoxyphenyl)-5-(3-pyridyl)-1,2,4-triazol-3-yl]sulfanylmethyl]thiazole-4-carboxamide CAS Name: N-ethoxy-2-[[[4-(2-methoxyphenyl)-5-(3-pyridinyl)-1,2,4-triazol-3-yl]thio]methyl]-4-thiazolecarboxamide IUPAC Name: N-ethoxy-2-[[4-(2-methoxyphenyl)-5-pyridin-3-yl-1,2,4-triazol-3-yl]sulfanylmethyl]-1,3-thiazole-4-carboxamide Traditional Name: N-ethoxy-2-[[[4-(2-methoxyphenyl)-5-(3-pyridyl)-1,2,4-triazol-3-yl]thio]methyl]thiazole-4-carboxamide Formula: C21H20N6O3S2 MolecularWeight: 468.5519

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Descriptors Computed from Structure

Canonical SMILES:

CCONC(=O)C1=CSC(=N1)CSC2=NN=C(N2C3=CC=CC=C3OC)C4=CN=CC=C4

Isomeric SMILES

CCONC(=O)C1=CSC(=N1)CSC2=NN=C(N2C3=CC=CC=C3OC)C4=CN=CC=C4

InChI

InChI=1S/C21H20N6O3S2/c1-3-30-26-20(28)15-12-31-18(23-15)13-32-21-25-24-19(14-7-6-10-22-11-14)27(21)16-8-4-5-9-17(16)29-2/h4-12H,3,13H2,1-2H3,(H,26,28)