[2-(cyclohexylmethylamino)-2-oxidanylidene-ethyl] 2-(4-bromophenyl)sulfanylethanoate

Systemtic Name: [2-(cyclohexylmethylamino)-2-oxidanylidene-ethyl] 2-(4-bromophenyl)sulfanylethanoate Openeye Name: [2-(cyclohexylmethylamino)-2-oxo-ethyl] 2-(4-bromophenyl)sulfanylacetate CAS Name: 2-[(4-bromophenyl)thio]acetic acid [2-(cyclohexylmethylamino)-2-oxoethyl] ester IUPAC Name: [2-(cyclohexylmethylamino)-2-oxoethyl] 2-(4-bromophenyl)sulfanylacetate Traditional Name: 2-[(4-bromophenyl)thio]acetic acid [2-(cyclohexylmethylamino)-2-keto-ethyl] ester Formula: C17H22BrNO3S MolecularWeight: 400.33048

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CNC(=O)COC(=O)CSC2=CC=C(C=C2)Br

Isomeric SMILES

C1CCC(CC1)CNC(=O)COC(=O)CSC2=CC=C(C=C2)Br

InChI

InChI=1S/C17H22BrNO3S/c18-14-6-8-15(9-7-14)23-12-17(21)22-11-16(20)19-10-13-4-2-1-3-5-13/h6-9,13H,1-5,10-12H2,(H,19,20)