2-[(4-tert-butylphenoxy)methyl]-3-(hydroxymethyl)-1-methyl-thiochromeno[4,3-b]pyrrol-4-one

Systemtic Name: 2-[(4-tert-butylphenoxy)methyl]-3-(hydroxymethyl)-1-methyl-thiochromeno[4,3-b]pyrrol-4-one Openeye Name: 2-[(4-tert-butylphenoxy)methyl]-3-(hydroxymethyl)-1-methyl-thiochromeno[4,3-b]pyrrol-4-one CAS Name: 2-[(4-tert-butylphenoxy)methyl]-3-(hydroxymethyl)-1-methyl-4-thiochromeno[4,3-b]pyrrolone IUPAC Name: 2-[(4-tert-butylphenoxy)methyl]-3-(hydroxymethyl)-1-methylthiochromeno[4,3-b]pyrrol-4-one Traditional Name: 2-[(4-tert-butylphenoxy)methyl]-1-methyl-3-methylol-thiochromeno[4,3-b]pyrrol-4-one Formula: C24H25NO3S MolecularWeight: 407.5252

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)OCC2=C(C3=C(N2C)C4=CC=CC=C4SC3=O)CO

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)OCC2=C(C3=C(N2C)C4=CC=CC=C4SC3=O)CO

InChI

InChI=1S/C24H25NO3S/c1-24(2,3)15-9-11-16(12-10-15)28-14-19-18(13-26)21-22(25(19)4)17-7-5-6-8-20(17)29-23(21)27/h5-12,26H,13-14H2,1-4H3