methyl 2-[4-(cyclohexylcarbonylamino)phenyl]sulfanylethanoate

Systemtic Name: methyl 2-[4-(cyclohexylcarbonylamino)phenyl]sulfanylethanoate Openeye Name: methyl 2-[4-(cyclohexanecarbonylamino)phenyl]sulfanylacetate CAS Name: 2-[[4-[[cyclohexyl(oxo)methyl]amino]phenyl]thio]acetic acid methyl ester IUPAC Name: methyl 2-[4-(cyclohexanecarbonylamino)phenyl]sulfanylacetate Traditional Name: 2-[[4-(cyclohexanecarbonylamino)phenyl]thio]acetic acid methyl ester Formula: C16H21NO3S MolecularWeight: 307.40784

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CSC1=CC=C(C=C1)NC(=O)C2CCCCC2

Isomeric SMILES

COC(=O)CSC1=CC=C(C=C1)NC(=O)C2CCCCC2

InChI

InChI=1S/C16H21NO3S/c1-20-15(18)11-21-14-9-7-13(8-10-14)17-16(19)12-5-3-2-4-6-12/h7-10,12H,2-6,11H2,1H3,(H,17,19)