propan-2-yl 4-(3-methylsulfanylpropylamino)benzoate

Systemtic Name: propan-2-yl 4-(3-methylsulfanylpropylamino)benzoate Openeye Name: isopropyl 4-(3-methylsulfanylpropylamino)benzoate CAS Name: 4-[3-(methylthio)propylamino]benzoic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-(3-methylsulfanylpropylamino)benzoate Traditional Name: 4-[3-(methylthio)propylamino]benzoic acid isopropyl ester Formula: C14H21NO2S MolecularWeight: 267.38704

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C1=CC=C(C=C1)NCCCSC

Isomeric SMILES

CC(C)OC(=O)C1=CC=C(C=C1)NCCCSC

InChI

InChI=1S/C14H21NO2S/c1-11(2)17-14(16)12-5-7-13(8-6-12)15-9-4-10-18-3/h5-8,11,15H,4,9-10H2,1-3H3