ethyl 4-methyl-2-[2-[(4-methyl-5-pyridin-2-yl-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]-1,3-thiazole-5-carboxylate

Systemtic Name: ethyl 4-methyl-2-[2-[(4-methyl-5-pyridin-2-yl-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]-1,3-thiazole-5-carboxylate Openeye Name: ethyl 4-methyl-2-[[2-[[4-methyl-5-(2-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]thiazole-5-carboxylate CAS Name: 4-methyl-2-[[2-[[4-methyl-5-(2-pyridinyl)-1,2,4-triazol-3-yl]thio]-1-oxoethyl]amino]-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-methyl-2-[[2-[(4-methyl-5-pyridin-2-yl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]-1,3-thiazole-5-carboxylate Traditional Name: 4-methyl-2-[[2-[[4-methyl-5-(2-pyridyl)-1,2,4-triazol-3-yl]thio]acetyl]amino]thiazole-5-carboxylic acid ethyl ester Formula: C17H18N6O3S2 MolecularWeight: 418.49322

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(S1)NC(=O)CSC2=NN=C(N2C)C3=CC=CC=N3)C

Isomeric SMILES

CCOC(=O)C1=C(N=C(S1)NC(=O)CSC2=NN=C(N2C)C3=CC=CC=N3)C

InChI

InChI=1S/C17H18N6O3S2/c1-4-26-15(25)13-10(2)19-16(28-13)20-12(24)9-27-17-22-21-14(23(17)3)11-7-5-6-8-18-11/h5-8H,4,9H2,1-3H3,(H,19,20,24)