methyl 4-[(2-cyclopentylsulfanylethanoylamino)methyl]benzoate

Systemtic Name: methyl 4-[(2-cyclopentylsulfanylethanoylamino)methyl]benzoate Openeye Name: methyl 4-[[(2-cyclopentylsulfanylacetyl)amino]methyl]benzoate CAS Name: 4-[[[2-(cyclopentylthio)-1-oxoethyl]amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[(2-cyclopentylsulfanylacetyl)amino]methyl]benzoate Traditional Name: 4-[[[2-(cyclopentylthio)acetyl]amino]methyl]benzoic acid methyl ester Formula: C16H21NO3S MolecularWeight: 307.40784

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CNC(=O)CSC2CCCC2

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CNC(=O)CSC2CCCC2

InChI

InChI=1S/C16H21NO3S/c1-20-16(19)13-8-6-12(7-9-13)10-17-15(18)11-21-14-4-2-3-5-14/h6-9,14H,2-5,10-11H2,1H3,(H,17,18)