2-(4-chlorophenyl)-4-methyl-5-[2-(phenylmethylsulfanyl)pyrimidin-4-yl]-1,3-thiazole

Systemtic Name: 2-(4-chlorophenyl)-4-methyl-5-[2-(phenylmethylsulfanyl)pyrimidin-4-yl]-1,3-thiazole Openeye Name: 5-(2-benzylsulfanylpyrimidin-4-yl)-2-(4-chlorophenyl)-4-methyl-thiazole CAS Name: 2-(4-chlorophenyl)-4-methyl-5-[2-(phenylmethylthio)-4-pyrimidinyl]thiazole IUPAC Name: 5-(2-benzylsulfanylpyrimidin-4-yl)-2-(4-chlorophenyl)-4-methyl-1,3-thiazole Traditional Name: 5-[2-(benzylthio)pyrimidin-4-yl]-2-(4-chlorophenyl)-4-methyl-thiazole Formula: C21H16ClN3S2 MolecularWeight: 409.95484

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)C2=CC=C(C=C2)Cl)C3=NC(=NC=C3)SCC4=CC=CC=C4

Isomeric SMILES

CC1=C(SC(=N1)C2=CC=C(C=C2)Cl)C3=NC(=NC=C3)SCC4=CC=CC=C4

InChI

InChI=1S/C21H16ClN3S2/c1-14-19(27-20(24-14)16-7-9-17(22)10-8-16)18-11-12-23-21(25-18)26-13-15-5-3-2-4-6-15/h2-12H,13H2,1H3