ethyl 4-phenyl-2-[2-(1H-1,2,4-triazol-5-ylsulfanyl)ethanoylamino]-1,3-thiazole-5-carboxylate

Systemtic Name: ethyl 4-phenyl-2-[2-(1H-1,2,4-triazol-5-ylsulfanyl)ethanoylamino]-1,3-thiazole-5-carboxylate Openeye Name: ethyl 4-phenyl-2-[[2-(1H-1,2,4-triazol-5-ylsulfanyl)acetyl]amino]thiazole-5-carboxylate CAS Name: 2-[[1-oxo-2-(1H-1,2,4-triazol-5-ylthio)ethyl]amino]-4-phenyl-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-phenyl-2-[[2-(1H-1,2,4-triazol-5-ylsulfanyl)acetyl]amino]-1,3-thiazole-5-carboxylate Traditional Name: 4-phenyl-2-[[2-(1H-1,2,4-triazol-5-ylthio)acetyl]amino]thiazole-5-carboxylic acid ethyl ester Formula: C16H15N5O3S2 MolecularWeight: 389.452

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(S1)NC(=O)CSC2=NC=NN2)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=C(N=C(S1)NC(=O)CSC2=NC=NN2)C3=CC=CC=C3

InChI

InChI=1S/C16H15N5O3S2/c1-2-24-14(23)13-12(10-6-4-3-5-7-10)20-16(26-13)19-11(22)8-25-15-17-9-18-21-15/h3-7,9H,2,8H2,1H3,(H,17,18,21)(H,19,20,22)