4-[(2-methoxyphenyl)methylsulfanylmethyl]-6,7-dimethyl-chromen-2-one

Systemtic Name: 4-[(2-methoxyphenyl)methylsulfanylmethyl]-6,7-dimethyl-chromen-2-one Openeye Name: 4-[(2-methoxyphenyl)methylsulfanylmethyl]-6,7-dimethyl-chromen-2-one CAS Name: 4-[[(2-methoxyphenyl)methylthio]methyl]-6,7-dimethyl-1-benzopyran-2-one IUPAC Name: 4-[(2-methoxyphenyl)methylsulfanylmethyl]-6,7-dimethylchromen-2-one Traditional Name: 6,7-dimethyl-4-[(o-anisylthio)methyl]coumarin Formula: C20H20O3S MolecularWeight: 340.436

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=CC(=O)O2)CSCC3=CC=CC=C3OC)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=CC(=O)O2)CSCC3=CC=CC=C3OC)C

InChI

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