[2-(3,4-dihydro-2H-chromen-4-ylamino)-2-oxidanylidene-ethyl] 3-phenylsulfanylpropanoate

Systemtic Name: [2-(3,4-dihydro-2H-chromen-4-ylamino)-2-oxidanylidene-ethyl] 3-phenylsulfanylpropanoate Openeye Name: [2-(chroman-4-ylamino)-2-oxo-ethyl] 3-phenylsulfanylpropanoate CAS Name: 3-(phenylthio)propanoic acid [2-(3,4-dihydro-2H-1-benzopyran-4-ylamino)-2-oxoethyl] ester IUPAC Name: [2-(3,4-dihydro-2H-chromen-4-ylamino)-2-oxoethyl] 3-phenylsulfanylpropanoate Traditional Name: 3-(phenylthio)propionic acid [2-(chroman-4-ylamino)-2-keto-ethyl] ester Formula: C20H21NO4S MolecularWeight: 371.45004

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=CC=CC=C2C1NC(=O)COC(=O)CCSC3=CC=CC=C3

Isomeric SMILES

C1COC2=CC=CC=C2C1NC(=O)COC(=O)CCSC3=CC=CC=C3

InChI

InChI=1S/C20H21NO4S/c22-19(21-17-10-12-24-18-9-5-4-8-16(17)18)14-25-20(23)11-13-26-15-6-2-1-3-7-15/h1-9,17H,10-14H2,(H,21,22)