(NE)-N-[3-[bis(3-methylbutyl)amino]-4-oxidanylidene-naphthalen-1-ylidene]-4-methyl-benzenesulfonamide

Systemtic Name: (NE)-N-[3-[bis(3-methylbutyl)amino]-4-oxidanylidene-naphthalen-1-ylidene]-4-methyl-benzenesulfonamide Openeye Name: (NE)-N-[3-(diisopentylamino)-4-oxo-1-naphthylidene]-4-methyl-benzenesulfonamide CAS Name: (NE)-N-[3-[bis(3-methylbutyl)amino]-4-oxo-1-naphthalenylidene]-4-methylbenzenesulfonamide IUPAC Name: (NE)-N-[3-[bis(3-methylbutyl)amino]-4-oxonaphthalen-1-ylidene]-4-methylbenzenesulfonamide Traditional Name: (NE)-N-[3-(diisoamylamino)-4-keto-1-naphthylidene]-4-methyl-benzenesulfonamide Formula: C27H34N2O3S MolecularWeight: 466.63546

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N=C2C=C(C(=O)C3=CC=CC=C32)N(CCC(C)C)CCC(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)/N=C/2\C=C(C(=O)C3=CC=CC=C32)N(CCC(C)C)CCC(C)C

InChI

InChI=1S/C27H34N2O3S/c1-19(2)14-16-29(17-15-20(3)4)26-18-25(23-8-6-7-9-24(23)27(26)30)28-33(31,32)22-12-10-21(5)11-13-22/h6-13,18-20H,14-17H2,1-5H3/b28-25+