O-propan-2-yl [2-imidazol-1-yl-1-(4-methylphenyl)ethyl]sulfanylmethanethioate

Systemtic Name: O-propan-2-yl [2-imidazol-1-yl-1-(4-methylphenyl)ethyl]sulfanylmethanethioate Openeye Name: O-isopropyl [2-imidazol-1-yl-1-(p-tolyl)ethyl]sulfanylmethanethioate CAS Name: [[2-(1-imidazolyl)-1-(4-methylphenyl)ethyl]thio]methanethioic acid O-propan-2-yl ester IUPAC Name: O-propan-2-yl [2-imidazol-1-yl-1-(4-methylphenyl)ethyl]sulfanylmethanethioate Traditional Name: [[2-imidazol-1-yl-1-(p-tolyl)ethyl]thio]methanethioic acid O-isopropyl ester Formula: C16H20N2OS2 MolecularWeight: 320.4728

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(CN2C=CN=C2)SC(=S)OC(C)C

Isomeric SMILES

CC1=CC=C(C=C1)C(CN2C=CN=C2)SC(=S)OC(C)C

InChI

InChI=1S/C16H20N2OS2/c1-12(2)19-16(20)21-15(10-18-9-8-17-11-18)14-6-4-13(3)5-7-14/h4-9,11-12,15H,10H2,1-3H3