(6,7-dimethyl-2-oxidanylidene-chromen-4-yl)methyl 2-[(5-chloranylthiophen-2-yl)methylsulfanyl]ethanoate

Systemtic Name: (6,7-dimethyl-2-oxidanylidene-chromen-4-yl)methyl 2-[(5-chloranylthiophen-2-yl)methylsulfanyl]ethanoate Openeye Name: (6,7-dimethyl-2-oxo-chromen-4-yl)methyl 2-[(5-chloro-2-thienyl)methylsulfanyl]acetate CAS Name: 2-[(5-chloro-2-thiophenyl)methylthio]acetic acid (6,7-dimethyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (6,7-dimethyl-2-oxochromen-4-yl)methyl 2-[(5-chlorothiophen-2-yl)methylsulfanyl]acetate Traditional Name: 2-[(5-chloro-2-thienyl)methylthio]acetic acid (2-keto-6,7-dimethyl-chromen-4-yl)methyl ester Formula: C19H17ClO4S2 MolecularWeight: 408.91888

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=CC(=O)O2)COC(=O)CSCC3=CC=C(S3)Cl)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=CC(=O)O2)COC(=O)CSCC3=CC=C(S3)Cl)C

InChI

InChI=1S/C19H17ClO4S2/c1-11-5-15-13(7-18(21)24-16(15)6-12(11)2)8-23-19(22)10-25-9-14-3-4-17(20)26-14/h3-7H,8-10H2,1-2H3