N-(3,5-ditert-butyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)-N'-(phenylsulfonyl)benzenecarboximidamide

Systemtic Name: N-(3,5-ditert-butyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)-N'-(phenylsulfonyl)benzenecarboximidamide Openeye Name: N'-(benzenesulfonyl)-N-(3,5-ditert-butyl-4-oxo-cyclohexa-2,5-dien-1-ylidene)benzamidine CAS Name: N'-(benzenesulfonyl)-N-(3,5-ditert-butyl-4-oxo-1-cyclohexa-2,5-dienylidene)benzenecarboximidamide IUPAC Name: N'-(benzenesulfonyl)-N-(3,5-ditert-butyl-4-oxocyclohexa-2,5-dien-1-ylidene)benzenecarboximidamide Traditional Name: N'-besyl-N-(3,5-ditert-butyl-4-keto-cyclohexa-2,5-dien-1-ylidene)benzamidine Formula: C27H30N2O3S MolecularWeight: 462.6037

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=NC(=NS(=O)(=O)C2=CC=CC=C2)C3=CC=CC=C3)C=C(C1=O)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1=CC(=NC(=NS(=O)(=O)C2=CC=CC=C2)C3=CC=CC=C3)C=C(C1=O)C(C)(C)C

InChI

InChI=1S/C27H30N2O3S/c1-26(2,3)22-17-20(18-23(24(22)30)27(4,5)6)28-25(19-13-9-7-10-14-19)29-33(31,32)21-15-11-8-12-16-21/h7-18H,1-6H3