7-ethyl-4-[(4-methoxyphenyl)sulfanylmethyl]chromen-2-one

Systemtic Name: 7-ethyl-4-[(4-methoxyphenyl)sulfanylmethyl]chromen-2-one Openeye Name: 7-ethyl-4-[(4-methoxyphenyl)sulfanylmethyl]chromen-2-one CAS Name: 7-ethyl-4-[[(4-methoxyphenyl)thio]methyl]-1-benzopyran-2-one IUPAC Name: 7-ethyl-4-[(4-methoxyphenyl)sulfanylmethyl]chromen-2-one Traditional Name: 7-ethyl-4-[[(4-methoxyphenyl)thio]methyl]coumarin Formula: C19H18O3S MolecularWeight: 326.40942

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)C(=CC(=O)O2)CSC3=CC=C(C=C3)OC

Isomeric SMILES

CCC1=CC2=C(C=C1)C(=CC(=O)O2)CSC3=CC=C(C=C3)OC

InChI

InChI=1S/C19H18O3S/c1-3-13-4-9-17-14(11-19(20)22-18(17)10-13)12-23-16-7-5-15(21-2)6-8-16/h4-11H,3,12H2,1-2H3