[2-(3,4-dihydro-2H-chromen-4-ylamino)-2-oxidanylidene-ethyl] 2-[(3-chlorophenyl)methylsulfanyl]ethanoate

Systemtic Name: [2-(3,4-dihydro-2H-chromen-4-ylamino)-2-oxidanylidene-ethyl] 2-[(3-chlorophenyl)methylsulfanyl]ethanoate Openeye Name: [2-(chroman-4-ylamino)-2-oxo-ethyl] 2-[(3-chlorophenyl)methylsulfanyl]acetate CAS Name: 2-[(3-chlorophenyl)methylthio]acetic 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] 2-[(3-chlorophenyl)methylsulfanyl]acetate Traditional Name: 2-[(3-chlorobenzyl)thio]acetic acid [2-(chroman-4-ylamino)-2-keto-ethyl] ester Formula: C20H20ClNO4S MolecularWeight: 405.8951

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=CC=CC=C2C1NC(=O)COC(=O)CSCC3=CC(=CC=C3)Cl

Isomeric SMILES

C1COC2=CC=CC=C2C1NC(=O)COC(=O)CSCC3=CC(=CC=C3)Cl

InChI

InChI=1S/C20H20ClNO4S/c21-15-5-3-4-14(10-15)12-27-13-20(24)26-11-19(23)22-17-8-9-25-18-7-2-1-6-16(17)18/h1-7,10,17H,8-9,11-13H2,(H,22,23)