3-[bis(azanyl)methylidene]-N-[2-(2-ethyl-6-oxidanyl-4-propan-2-yl-phenyl)ethyl]-6-oxidanylidene-cyclohexa-1,4-diene-1-sulfonamide

Systemtic Name: 3-[bis(azanyl)methylidene]-N-[2-(2-ethyl-6-oxidanyl-4-propan-2-yl-phenyl)ethyl]-6-oxidanylidene-cyclohexa-1,4-diene-1-sulfonamide Openeye Name: 3-(diaminomethylene)-N-[2-(2-ethyl-6-hydroxy-4-isopropyl-phenyl)ethyl]-6-oxo-cyclohexa-1,4-diene-1-sulfonamide CAS Name: 3-(diaminomethylidene)-N-[2-(2-ethyl-6-hydroxy-4-propan-2-ylphenyl)ethyl]-6-oxo-1-cyclohexa-1,4-dienesulfonamide IUPAC Name: 3-(diaminomethylidene)-N-[2-(2-ethyl-6-hydroxy-4-propan-2-ylphenyl)ethyl]-6-oxocyclohexa-1,4-diene-1-sulfonamide Traditional Name: 3-(diaminomethylene)-N-[2-(2-ethyl-6-hydroxy-4-isopropyl-phenyl)ethyl]-6-keto-cyclohexa-1,4-diene-1-sulfonamide Formula: C20H27N3O4S MolecularWeight: 405.51108

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC(=C1)C(C)C)O)CCNS(=O)(=O)C2=CC(=C(N)N)C=CC2=O

Isomeric SMILES

CCC1=C(C(=CC(=C1)C(C)C)O)CCNS(=O)(=O)C2=CC(=C(N)N)C=CC2=O

InChI

InChI=1S/C20H27N3O4S/c1-4-13-9-15(12(2)3)10-18(25)16(13)7-8-23-28(26,27)19-11-14(20(21)22)5-6-17(19)24/h5-6,9-12,23,25H,4,7-8,21-22H2,1-3H3