tert-butyl 2-methyl-4-phenyl-2H-thiochromene-3-carboxylate

Systemtic Name: tert-butyl 2-methyl-4-phenyl-2H-thiochromene-3-carboxylate Openeye Name: tert-butyl 2-methyl-4-phenyl-2H-thiochromene-3-carboxylate CAS Name: 2-methyl-4-phenyl-2H-1-benzothiopyran-3-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-methyl-4-phenyl-2H-thiochromene-3-carboxylate Traditional Name: 2-methyl-4-phenyl-2H-thiochromene-3-carboxylic acid tert-butyl ester Formula: C21H22O2S MolecularWeight: 338.46318

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=C(C2=CC=CC=C2S1)C3=CC=CC=C3)C(=O)OC(C)(C)C

Isomeric SMILES

CC1C(=C(C2=CC=CC=C2S1)C3=CC=CC=C3)C(=O)OC(C)(C)C

InChI

InChI=1S/C21H22O2S/c1-14-18(20(22)23-21(2,3)4)19(15-10-6-5-7-11-15)16-12-8-9-13-17(16)24-14/h5-14H,1-4H3