4-[[2,5-bis(chloranyl)phenyl]sulfanylmethyl]-7-methyl-6-propan-2-yl-chromen-2-one

Systemtic Name: 4-[[2,5-bis(chloranyl)phenyl]sulfanylmethyl]-7-methyl-6-propan-2-yl-chromen-2-one Openeye Name: 4-[(2,5-dichlorophenyl)sulfanylmethyl]-6-isopropyl-7-methyl-chromen-2-one CAS Name: 4-[[(2,5-dichlorophenyl)thio]methyl]-7-methyl-6-propan-2-yl-1-benzopyran-2-one IUPAC Name: 4-[(2,5-dichlorophenyl)sulfanylmethyl]-7-methyl-6-propan-2-ylchromen-2-one Traditional Name: 4-[[(2,5-dichlorophenyl)thio]methyl]-6-isopropyl-7-methyl-coumarin Formula: C20H18Cl2O2S MolecularWeight: 393.32672

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=CC(=O)OC2=C1)CSC3=C(C=CC(=C3)Cl)Cl)C(C)C

Isomeric SMILES

CC1=C(C=C2C(=CC(=O)OC2=C1)CSC3=C(C=CC(=C3)Cl)Cl)C(C)C

InChI

InChI=1S/C20H18Cl2O2S/c1-11(2)15-9-16-13(7-20(23)24-18(16)6-12(15)3)10-25-19-8-14(21)4-5-17(19)22/h4-9,11H,10H2,1-3H3