2-(2-chlorophenyl)-4-[(5-phenethyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanylmethyl]-1,3-thiazole

Systemtic Name: 2-(2-chlorophenyl)-4-[(5-phenethyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanylmethyl]-1,3-thiazole Openeye Name: 4-[(4-allyl-5-phenethyl-1,2,4-triazol-3-yl)sulfanylmethyl]-2-(2-chlorophenyl)thiazole CAS Name: 2-(2-chlorophenyl)-4-[[(5-phenethyl-4-prop-2-enyl-1,2,4-triazol-3-yl)thio]methyl]thiazole IUPAC Name: 2-(2-chlorophenyl)-4-[(5-phenethyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanylmethyl]-1,3-thiazole Traditional Name: 4-[[(4-allyl-5-phenethyl-1,2,4-triazol-3-yl)thio]methyl]-2-(2-chlorophenyl)thiazole Formula: C23H21ClN4S2 MolecularWeight: 453.02264

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=NN=C1SCC2=CSC(=N2)C3=CC=CC=C3Cl)CCC4=CC=CC=C4

Isomeric SMILES

C=CCN1C(=NN=C1SCC2=CSC(=N2)C3=CC=CC=C3Cl)CCC4=CC=CC=C4

InChI

InChI=1S/C23H21ClN4S2/c1-2-14-28-21(13-12-17-8-4-3-5-9-17)26-27-23(28)30-16-18-15-29-22(25-18)19-10-6-7-11-20(19)24/h2-11,15H,1,12-14,16H2