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

Systemtic Name: 7-ethyl-4-[(2-methoxyphenyl)methylsulfanylmethyl]chromen-2-one Openeye Name: 7-ethyl-4-[(2-methoxyphenyl)methylsulfanylmethyl]chromen-2-one CAS Name: 7-ethyl-4-[[(2-methoxyphenyl)methylthio]methyl]-1-benzopyran-2-one IUPAC Name: 7-ethyl-4-[(2-methoxyphenyl)methylsulfanylmethyl]chromen-2-one Traditional Name: 7-ethyl-4-[(o-anisylthio)methyl]coumarin Formula: C20H20O3S MolecularWeight: 340.436

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)C(=CC(=O)O2)CSCC3=CC=CC=C3OC

Isomeric SMILES

CCC1=CC2=C(C=C1)C(=CC(=O)O2)CSCC3=CC=CC=C3OC

InChI

InChI=1S/C20H20O3S/c1-3-14-8-9-17-16(11-20(21)23-19(17)10-14)13-24-12-15-6-4-5-7-18(15)22-2/h4-11H,3,12-13H2,1-2H3