[2-(cyclopentylamino)-2-oxidanylidene-ethyl] 3-(4-methylsulfanylphenyl)prop-2-enoate

Systemtic Name: [2-(cyclopentylamino)-2-oxidanylidene-ethyl] 3-(4-methylsulfanylphenyl)prop-2-enoate Openeye Name: [2-(cyclopentylamino)-2-oxo-ethyl] 3-(4-methylsulfanylphenyl)prop-2-enoate CAS Name: 3-[4-(methylthio)phenyl]-2-propenoic acid [2-(cyclopentylamino)-2-oxoethyl] ester IUPAC Name: [2-(cyclopentylamino)-2-oxoethyl] 3-(4-methylsulfanylphenyl)prop-2-enoate Traditional Name: 3-[4-(methylthio)phenyl]acrylic acid [2-(cyclopentylamino)-2-keto-ethyl] ester Formula: C17H21NO3S MolecularWeight: 319.41854

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C=CC(=O)OCC(=O)NC2CCCC2

Isomeric SMILES

CSC1=CC=C(C=C1)C=CC(=O)OCC(=O)NC2CCCC2

InChI

InChI=1S/C17H21NO3S/c1-22-15-9-6-13(7-10-15)8-11-17(20)21-12-16(19)18-14-4-2-3-5-14/h6-11,14H,2-5,12H2,1H3,(H,18,19)