4-[5-[(4-chlorophenyl)methylsulfanyl]-4-methyl-1,2,4-triazol-3-yl]-2-methyl-1,3-thiazole

Systemtic Name: 4-[5-[(4-chlorophenyl)methylsulfanyl]-4-methyl-1,2,4-triazol-3-yl]-2-methyl-1,3-thiazole Openeye Name: 4-[5-[(4-chlorophenyl)methylsulfanyl]-4-methyl-1,2,4-triazol-3-yl]-2-methyl-thiazole CAS Name: 4-[5-[(4-chlorophenyl)methylthio]-4-methyl-1,2,4-triazol-3-yl]-2-methylthiazole IUPAC Name: 4-[5-[(4-chlorophenyl)methylsulfanyl]-4-methyl-1,2,4-triazol-3-yl]-2-methyl-1,3-thiazole Traditional Name: 4-[5-[(4-chlorobenzyl)thio]-4-methyl-1,2,4-triazol-3-yl]-2-methyl-thiazole Formula: C14H13ClN4S2 MolecularWeight: 336.86282

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)C2=NN=C(N2C)SCC3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=NC(=CS1)C2=NN=C(N2C)SCC3=CC=C(C=C3)Cl

InChI

InChI=1S/C14H13ClN4S2/c1-9-16-12(8-20-9)13-17-18-14(19(13)2)21-7-10-3-5-11(15)6-4-10/h3-6,8H,7H2,1-2H3