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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C(=C1C)OC(=O)C)C)CCC(O2)(C)C(=S)NC3=CC=CC=C3

Isomeric SMILES

CC1=C2C(=C(C(=C1C)OC(=O)C)C)CCC(O2)(C)C(=S)NC3=CC=CC=C3

InChI

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