(NE)-4-bromanyl-N-[3-[(4-butylphenyl)amino]-4-oxidanylidene-naphthalen-1-ylidene]benzenesulfonamide

Systemtic Name: (NE)-4-bromanyl-N-[3-[(4-butylphenyl)amino]-4-oxidanylidene-naphthalen-1-ylidene]benzenesulfonamide Openeye Name: (NE)-4-bromo-N-[3-(4-butylanilino)-4-oxo-1-naphthylidene]benzenesulfonamide CAS Name: (NE)-4-bromo-N-[3-(4-butylanilino)-4-oxo-1-naphthalenylidene]benzenesulfonamide IUPAC Name: (NE)-4-bromo-N-[3-(4-butylanilino)-4-oxonaphthalen-1-ylidene]benzenesulfonamide Traditional Name: (NE)-4-bromo-N-[3-(4-butylanilino)-4-keto-1-naphthylidene]benzenesulfonamide Formula: C26H23BrN2O3S MolecularWeight: 523.44142

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC2=CC(=NS(=O)(=O)C3=CC=C(C=C3)Br)C4=CC=CC=C4C2=O

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC2=C/C(=N\S(=O)(=O)C3=CC=C(C=C3)Br)/C4=CC=CC=C4C2=O

InChI

InChI=1S/C26H23BrN2O3S/c1-2-3-6-18-9-13-20(14-10-18)28-25-17-24(22-7-4-5-8-23(22)26(25)30)29-33(31,32)21-15-11-19(27)12-16-21/h4-5,7-17,28H,2-3,6H2,1H3/b29-24+