ethyl 2-[3-(5,7-dimethyl-4-sulfanylidene-chromen-2-yl)phenyl]ethanoate

Systemtic Name: ethyl 2-[3-(5,7-dimethyl-4-sulfanylidene-chromen-2-yl)phenyl]ethanoate Openeye Name: ethyl 2-[3-(5,7-dimethyl-4-thioxo-chromen-2-yl)phenyl]acetate CAS Name: 2-[3-(5,7-dimethyl-4-sulfanylidene-1-benzopyran-2-yl)phenyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[3-(5,7-dimethyl-4-sulfanylidenechromen-2-yl)phenyl]acetate Traditional Name: 2-[3-(5,7-dimethyl-4-thioxo-chromen-2-yl)phenyl]acetic acid ethyl ester Formula: C21H20O3S MolecularWeight: 352.4467

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=CC=CC(=C1)C2=CC(=S)C3=C(C=C(C=C3O2)C)C

Isomeric SMILES

CCOC(=O)CC1=CC=CC(=C1)C2=CC(=S)C3=C(C=C(C=C3O2)C)C

InChI

InChI=1S/C21H20O3S/c1-4-23-20(22)11-15-6-5-7-16(10-15)17-12-19(25)21-14(3)8-13(2)9-18(21)24-17/h5-10,12H,4,11H2,1-3H3