(2,2,4,4-tetramethyl-3H-thiochromen-6-yl)carbamoyl benzoate

Systemtic Name: (2,2,4,4-tetramethyl-3H-thiochromen-6-yl)carbamoyl benzoate Openeye Name: (2,2,4,4-tetramethylthiochroman-6-yl)carbamoyl benzoate CAS Name: benzoic acid [oxo-[(2,2,4,4-tetramethyl-3H-1-benzothiopyran-6-yl)amino]methyl] ester IUPAC Name: (2,2,4,4-tetramethyl-3H-thiochromen-6-yl)carbamoyl benzoate Traditional Name: benzoic acid (2,2,4,4-tetramethylthiochroman-6-yl)carbamoyl ester Formula: C21H23NO3S MolecularWeight: 369.47722

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(SC2=C1C=C(C=C2)NC(=O)OC(=O)C3=CC=CC=C3)(C)C)C

Isomeric SMILES

CC1(CC(SC2=C1C=C(C=C2)NC(=O)OC(=O)C3=CC=CC=C3)(C)C)C

InChI

InChI=1S/C21H23NO3S/c1-20(2)13-21(3,4)26-17-11-10-15(12-16(17)20)22-19(24)25-18(23)14-8-6-5-7-9-14/h5-12H,13H2,1-4H3,(H,22,24)