[3,5,7,8-tetramethyl-2-(phenylcarbamothioyl)-3,4-dihydro-2H-chromen-6-yl] ethanoate

Systemtic Name: [3,5,7,8-tetramethyl-2-(phenylcarbamothioyl)-3,4-dihydro-2H-chromen-6-yl] ethanoate Openeye Name: [3,5,7,8-tetramethyl-2-(phenylcarbamothioyl)chroman-6-yl] acetate CAS Name: acetic acid [2-[anilino(sulfanylidene)methyl]-3,5,7,8-tetramethyl-3,4-dihydro-2H-1-benzopyran-6-yl] ester IUPAC Name: [3,5,7,8-tetramethyl-2-(phenylcarbamothioyl)-3,4-dihydro-2H-chromen-6-yl] acetate Traditional Name: acetic acid [3,5,7,8-tetramethyl-2-(phenylthiocarbamoyl)chroman-6-yl] ester Formula: C22H25NO3S MolecularWeight: 383.5038

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=C(C(=C(C(=C2OC1C(=S)NC3=CC=CC=C3)C)C)OC(=O)C)C

Isomeric SMILES

CC1CC2=C(C(=C(C(=C2OC1C(=S)NC3=CC=CC=C3)C)C)OC(=O)C)C

InChI

InChI=1S/C22H25NO3S/c1-12-11-18-15(4)20(25-16(5)24)13(2)14(3)21(18)26-19(12)22(27)23-17-9-7-6-8-10-17/h6-10,12,19H,11H2,1-5H3,(H,23,27)