methyl 6-tert-butyl-2-[3-(4-methylsulfanylphenyl)-4,6-bis(oxidanylidene)-2-phenyl-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazol-5-yl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Systemtic Name: methyl 6-tert-butyl-2-[3-(4-methylsulfanylphenyl)-4,6-bis(oxidanylidene)-2-phenyl-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazol-5-yl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Openeye Name: methyl 6-tert-butyl-2-[3-(4-methylsulfanylphenyl)-4,6-dioxo-2-phenyl-3a,6a-dihydro-3H-pyrrolo[3,4-d]isoxazol-5-yl]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate CAS Name: 6-tert-butyl-2-[3-[4-(methylthio)phenyl]-4,6-dioxo-2-phenyl-3a,6a-dihydro-3H-pyrrolo[3,4-d]isoxazol-5-yl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid methyl ester IUPAC Name: methyl 6-tert-butyl-2-[3-(4-methylsulfanylphenyl)-4,6-dioxo-2-phenyl-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazol-5-yl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Traditional Name: 6-tert-butyl-2-[4,6-diketo-3-[4-(methylthio)phenyl]-2-phenyl-3a,6a-dihydro-3H-pyrrol[3,4-d]isoxazol-5-yl]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid methyl ester Formula: C32H34N2O5S2 MolecularWeight: 590.75276

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CCC2=C(C1)SC(=C2C(=O)OC)N3C(=O)C4C(N(OC4C3=O)C5=CC=CC=C5)C6=CC=C(C=C6)SC

Isomeric SMILES

CC(C)(C)C1CCC2=C(C1)SC(=C2C(=O)OC)N3C(=O)C4C(N(OC4C3=O)C5=CC=CC=C5)C6=CC=C(C=C6)SC

InChI

InChI=1S/C32H34N2O5S2/c1-32(2,3)19-13-16-22-23(17-19)41-30(24(22)31(37)38-4)33-28(35)25-26(18-11-14-21(40-5)15-12-18)34(39-27(25)29(33)36)20-9-7-6-8-10-20/h6-12,14-15,19,25-27H,13,16-17H2,1-5H3