3-[(4-bromanyl-2-methyl-phenyl)amino]-3-oxidanylidene-propanethioate

Systemtic Name: 3-[(4-bromanyl-2-methyl-phenyl)amino]-3-oxidanylidene-propanethioate Openeye Name: 3-(4-bromo-2-methyl-anilino)-3-oxo-propanethioate CAS Name: 3-(4-bromo-2-methylanilino)-3-oxopropanethioate IUPAC Name: 3-(4-bromo-2-methylanilino)-3-oxopropanethioate Traditional Name: 3-(4-bromo-2-methyl-anilino)-3-keto-thiopropionate Formula: C10H9BrNO2S- MolecularWeight: 287.15296

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)NC(=O)CC(=S)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)Br)NC(=O)CC(=S)[O-]

InChI

InChI=1S/C10H10BrNO2S/c1-6-4-7(11)2-3-8(6)12-9(13)5-10(14)15/h2-4H,5H2,1H3,(H,12,13)(H,14,15)/p-1