[2-(3-methylbutylamino)-2-oxidanylidene-ethyl] 2-naphthalen-2-ylsulfanylethanoate

Systemtic Name: [2-(3-methylbutylamino)-2-oxidanylidene-ethyl] 2-naphthalen-2-ylsulfanylethanoate Openeye Name: [2-(isopentylamino)-2-oxo-ethyl] 2-(2-naphthylsulfanyl)acetate CAS Name: 2-(2-naphthalenylthio)acetic acid [2-(3-methylbutylamino)-2-oxoethyl] ester IUPAC Name: [2-(3-methylbutylamino)-2-oxoethyl] 2-naphthalen-2-ylsulfanylacetate Traditional Name: 2-(2-naphthylthio)acetic acid [2-(isoamylamino)-2-keto-ethyl] ester Formula: C19H23NO3S MolecularWeight: 345.45582

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)COC(=O)CSC1=CC2=CC=CC=C2C=C1

Isomeric SMILES

CC(C)CCNC(=O)COC(=O)CSC1=CC2=CC=CC=C2C=C1

InChI

InChI=1S/C19H23NO3S/c1-14(2)9-10-20-18(21)12-23-19(22)13-24-17-8-7-15-5-3-4-6-16(15)11-17/h3-8,11,14H,9-10,12-13H2,1-2H3,(H,20,21)