ethyl 2-[(2S,6R)-2,6-diphenylthian-4-ylidene]ethanoate

Systemtic Name: ethyl 2-[(2S,6R)-2,6-diphenylthian-4-ylidene]ethanoate Openeye Name: ethyl 2-[(2S,6R)-2,6-diphenyltetrahydrothiopyran-4-ylidene]acetate CAS Name: 2-[(2S,6R)-2,6-diphenyl-4-thianylidene]acetic acid ethyl ester IUPAC Name: ethyl 2-[(2S,6R)-2,6-diphenylthian-4-ylidene]acetate Traditional Name: 2-[(2S,6R)-2,6-diphenyltetrahydrothiopyran-4-ylidene]acetic acid ethyl ester Formula: C21H22O2S MolecularWeight: 338.46318

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=C1CC(SC(C1)C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C=C1C[C@@H](S[C@@H](C1)C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C21H22O2S/c1-2-23-21(22)15-16-13-19(17-9-5-3-6-10-17)24-20(14-16)18-11-7-4-8-12-18/h3-12,15,19-20H,2,13-14H2,1H3/t19-,20+