2,6-ditert-butyl-4-[(1-methyl-5-methylsulfanyl-pyrrol-3-yl)methyl]phenol

Systemtic Name: 2,6-ditert-butyl-4-[(1-methyl-5-methylsulfanyl-pyrrol-3-yl)methyl]phenol Openeye Name: 2,6-ditert-butyl-4-[(1-methyl-5-methylsulfanyl-pyrrol-3-yl)methyl]phenol CAS Name: 2,6-ditert-butyl-4-[[1-methyl-5-(methylthio)-3-pyrrolyl]methyl]phenol IUPAC Name: 2,6-ditert-butyl-4-[(1-methyl-5-methylsulfanylpyrrol-3-yl)methyl]phenol Traditional Name: 2,6-ditert-butyl-4-[[1-methyl-5-(methylthio)pyrrol-3-yl]methyl]phenol Formula: C21H31NOS MolecularWeight: 345.54194

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CC2=CN(C(=C2)SC)C

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CC2=CN(C(=C2)SC)C

InChI

InChI=1S/C21H31NOS/c1-20(2,3)16-10-14(11-17(19(16)23)21(4,5)6)9-15-12-18(24-8)22(7)13-15/h10-13,23H,9H2,1-8H3