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

Systemtic Name: 2-(2-methylphenyl)-4-[(4-prop-2-enyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanylmethyl]-1,3-thiazole Openeye Name: 4-[[4-allyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-2-(o-tolyl)thiazole CAS Name: 2-(2-methylphenyl)-4-[[(4-prop-2-enyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)thio]methyl]thiazole IUPAC Name: 2-(2-methylphenyl)-4-[(4-prop-2-enyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanylmethyl]-1,3-thiazole Traditional Name: 4-[[[4-allyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]thio]methyl]-2-(o-tolyl)thiazole Formula: C21H19N5S2 MolecularWeight: 405.53906

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=NC(=CS2)CSC3=NN=C(N3CC=C)C4=CC=NC=C4

Isomeric SMILES

CC1=CC=CC=C1C2=NC(=CS2)CSC3=NN=C(N3CC=C)C4=CC=NC=C4

InChI

InChI=1S/C21H19N5S2/c1-3-12-26-19(16-8-10-22-11-9-16)24-25-21(26)28-14-17-13-27-20(23-17)18-7-5-4-6-15(18)2/h3-11,13H,1,12,14H2,2H3