N-(5-hexadecoxy-4-methyl-2-oxidanyl-phenyl)-2-methyl-4-oxidanyl-3-[(2E)-2-(4-oxidanylidene-3-pyrrolidin-1-ylsulfonyl-naphthalen-1-ylidene)hydrazinyl]benzenesulfonamide

Systemtic Name: N-(5-hexadecoxy-4-methyl-2-oxidanyl-phenyl)-2-methyl-4-oxidanyl-3-[(2E)-2-(4-oxidanylidene-3-pyrrolidin-1-ylsulfonyl-naphthalen-1-ylidene)hydrazinyl]benzenesulfonamide Openeye Name: N-(5-hexadecoxy-2-hydroxy-4-methyl-phenyl)-4-hydroxy-2-methyl-3-[(2E)-2-(4-oxo-3-pyrrolidin-1-ylsulfonyl-1-naphthylidene)hydrazino]benzenesulfonamide CAS Name: N-(5-hexadecoxy-2-hydroxy-4-methylphenyl)-4-hydroxy-2-methyl-3-[(2E)-2-[4-oxo-3-(1-pyrrolidinylsulfonyl)-1-naphthalenylidene]hydrazinyl]benzenesulfonamide IUPAC Name: N-(5-hexadecoxy-2-hydroxy-4-methylphenyl)-4-hydroxy-2-methyl-3-[(2E)-2-(4-oxo-3-pyrrolidin-1-ylsulfonylnaphthalen-1-ylidene)hydrazinyl]benzenesulfonamide Traditional Name: N-(5-cetyloxy-2-hydroxy-4-methyl-phenyl)-4-hydroxy-3-[(N'E)-N'-(4-keto-3-pyrrolidinosulfonyl-1-naphthylidene)hydrazino]-2-methyl-benzenesulfonamide Formula: C44H60N4O8S2 MolecularWeight: 837.0992

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOC1=CC(=C(C=C1C)O)NS(=O)(=O)C2=C(C(=C(C=C2)O)NN=C3C=C(C(=O)C4=CC=CC=C43)S(=O)(=O)N5CCCC5)C

Isomeric SMILES

CCCCCCCCCCCCCCCCOC1=CC(=C(C=C1C)O)NS(=O)(=O)C2=C(C(=C(C=C2)O)N/N=C/3\C=C(C(=O)C4=CC=CC=C43)S(=O)(=O)N5CCCC5)C

InChI

InChI=1S/C44H60N4O8S2/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-21-28-56-40-30-37(39(50)29-32(40)2)47-57(52,53)41-25-24-38(49)43(33(41)3)46-45-36-31-42(58(54,55)48-26-19-20-27-48)44(51)35-23-18-17-22-34(35)36/h17-18,22-25,29-31,46-47,49-50H,4-16,19-21,26-28H2,1-3H3/b45-36+