S-[5-[(4-bromophenyl)amino]-2-(4-chlorophenyl)-1,3-thiazol-4-yl] 2-methylbenzenecarbothioate

Systemtic Name: S-[5-[(4-bromophenyl)amino]-2-(4-chlorophenyl)-1,3-thiazol-4-yl] 2-methylbenzenecarbothioate Openeye Name: S-[5-(4-bromoanilino)-2-(4-chlorophenyl)thiazol-4-yl] 2-methylbenzenecarbothioate CAS Name: 2-methylbenzenecarbothioic acid S-[5-(4-bromoanilino)-2-(4-chlorophenyl)-4-thiazolyl] ester IUPAC Name: S-[5-(4-bromoanilino)-2-(4-chlorophenyl)-1,3-thiazol-4-yl] 2-methylbenzenecarbothioate Traditional Name: 2-methylthiobenzoic acid S-[5-(4-bromoanilino)-2-(4-chlorophenyl)thiazol-4-yl] ester Formula: C23H16BrClN2OS2 MolecularWeight: 515.87294

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)SC2=C(SC(=N2)C3=CC=C(C=C3)Cl)NC4=CC=C(C=C4)Br

Isomeric SMILES

CC1=CC=CC=C1C(=O)SC2=C(SC(=N2)C3=CC=C(C=C3)Cl)NC4=CC=C(C=C4)Br

InChI

InChI=1S/C23H16BrClN2OS2/c1-14-4-2-3-5-19(14)23(28)30-22-21(26-18-12-8-16(24)9-13-18)29-20(27-22)15-6-10-17(25)11-7-15/h2-13,26H,1H3