2-(4-chlorophenyl)-4-(4-ethyl-5-prop-2-ynylsulfanyl-1,2,4-triazol-3-yl)-1,3-thiazole

Systemtic Name: 2-(4-chlorophenyl)-4-(4-ethyl-5-prop-2-ynylsulfanyl-1,2,4-triazol-3-yl)-1,3-thiazole Openeye Name: 2-(4-chlorophenyl)-4-(4-ethyl-5-prop-2-ynylsulfanyl-1,2,4-triazol-3-yl)thiazole CAS Name: 2-(4-chlorophenyl)-4-[4-ethyl-5-(prop-2-ynylthio)-1,2,4-triazol-3-yl]thiazole IUPAC Name: 2-(4-chlorophenyl)-4-(4-ethyl-5-prop-2-ynylsulfanyl-1,2,4-triazol-3-yl)-1,3-thiazole Traditional Name: 2-(4-chlorophenyl)-4-[4-ethyl-5-(propargylthio)-1,2,4-triazol-3-yl]thiazole Formula: C16H13ClN4S2 MolecularWeight: 360.88422

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC#C)C2=CSC(=N2)C3=CC=C(C=C3)Cl

Isomeric SMILES

CCN1C(=NN=C1SCC#C)C2=CSC(=N2)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C16H13ClN4S2/c1-3-9-22-16-20-19-14(21(16)4-2)13-10-23-15(18-13)11-5-7-12(17)8-6-11/h1,5-8,10H,4,9H2,2H3