(8-methyl-7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl 2-[(5-chloranylthiophen-2-yl)methylsulfanyl]ethanoate

Systemtic Name: (8-methyl-7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl 2-[(5-chloranylthiophen-2-yl)methylsulfanyl]ethanoate Openeye Name: (7-hydroxy-8-methyl-2-oxo-chromen-4-yl)methyl 2-[(5-chloro-2-thienyl)methylsulfanyl]acetate CAS Name: 2-[(5-chloro-2-thiophenyl)methylthio]acetic acid (7-hydroxy-8-methyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-hydroxy-8-methyl-2-oxochromen-4-yl)methyl 2-[(5-chlorothiophen-2-yl)methylsulfanyl]acetate Traditional Name: 2-[(5-chloro-2-thienyl)methylthio]acetic acid (7-hydroxy-2-keto-8-methyl-chromen-4-yl)methyl ester Formula: C18H15ClO5S2 MolecularWeight: 410.8917

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1OC(=O)C=C2COC(=O)CSCC3=CC=C(S3)Cl)O

Isomeric SMILES

CC1=C(C=CC2=C1OC(=O)C=C2COC(=O)CSCC3=CC=C(S3)Cl)O

InChI

InChI=1S/C18H15ClO5S2/c1-10-14(20)4-3-13-11(6-16(21)24-18(10)13)7-23-17(22)9-25-8-12-2-5-15(19)26-12/h2-6,20H,7-9H2,1H3