S-[2-[(4-iodanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl] benzenecarbothioate

Systemtic Name: S-[2-[(4-iodanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl] benzenecarbothioate Openeye Name: S-[2-(4-iodo-2-methyl-anilino)-2-oxo-ethyl] benzenecarbothioate CAS Name: benzenecarbothioic acid S-[2-(4-iodo-2-methylanilino)-2-oxoethyl] ester IUPAC Name: S-[2-(4-iodo-2-methylanilino)-2-oxoethyl] benzenecarbothioate Traditional Name: thiobenzoic acid S-[2-(4-iodo-2-methyl-anilino)-2-keto-ethyl] ester Formula: C16H14INO2S MolecularWeight: 411.25733

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)I)NC(=O)CSC(=O)C2=CC=CC=C2

Isomeric SMILES

CC1=C(C=CC(=C1)I)NC(=O)CSC(=O)C2=CC=CC=C2

InChI

InChI=1S/C16H14INO2S/c1-11-9-13(17)7-8-14(11)18-15(19)10-21-16(20)12-5-3-2-4-6-12/h2-9H,10H2,1H3,(H,18,19)