1-butyl-4-(3,5-ditert-butyl-4-oxidanyl-phenyl)carbonyl-3-sulfanylidene-2H-pyrrole-5-carbonitrile

Systemtic Name: 1-butyl-4-(3,5-ditert-butyl-4-oxidanyl-phenyl)carbonyl-3-sulfanylidene-2H-pyrrole-5-carbonitrile Openeye Name: 1-butyl-4-(3,5-ditert-butyl-4-hydroxy-benzoyl)-3-thioxo-2H-pyrrole-5-carbonitrile CAS Name: 1-butyl-4-[(3,5-ditert-butyl-4-hydroxyphenyl)-oxomethyl]-3-sulfanylidene-2H-pyrrole-5-carbonitrile IUPAC Name: 1-butyl-4-(3,5-ditert-butyl-4-hydroxybenzoyl)-3-sulfanylidene-2H-pyrrole-5-carbonitrile Traditional Name: 1-butyl-3-(3,5-ditert-butyl-4-hydroxy-benzoyl)-4-thioxo-2-pyrroline-2-carbonitrile Formula: C24H32N2O2S MolecularWeight: 412.58808

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1CC(=S)C(=C1C#N)C(=O)C2=CC(=C(C(=C2)C(C)(C)C)O)C(C)(C)C

Isomeric SMILES

CCCCN1CC(=S)C(=C1C#N)C(=O)C2=CC(=C(C(=C2)C(C)(C)C)O)C(C)(C)C

InChI

InChI=1S/C24H32N2O2S/c1-8-9-10-26-14-19(29)20(18(26)13-25)21(27)15-11-16(23(2,3)4)22(28)17(12-15)24(5,6)7/h11-12,28H,8-10,14H2,1-7H3