N-[3-[4,5-bis(4-methoxyphenyl)-1-propyl-imidazol-2-yl]sulfanylpropyl]-4-chloranyl-3-nitro-benzenesulfonamide

Systemtic Name: N-[3-[4,5-bis(4-methoxyphenyl)-1-propyl-imidazol-2-yl]sulfanylpropyl]-4-chloranyl-3-nitro-benzenesulfonamide Openeye Name: N-[3-[4,5-bis(4-methoxyphenyl)-1-propyl-imidazol-2-yl]sulfanylpropyl]-4-chloro-3-nitro-benzenesulfonamide CAS Name: N-[3-[[4,5-bis(4-methoxyphenyl)-1-propyl-2-imidazolyl]thio]propyl]-4-chloro-3-nitrobenzenesulfonamide IUPAC Name: N-[3-[4,5-bis(4-methoxyphenyl)-1-propylimidazol-2-yl]sulfanylpropyl]-4-chloro-3-nitrobenzenesulfonamide Traditional Name: N-[3-[[4,5-bis(4-methoxyphenyl)-1-propyl-imidazol-2-yl]thio]propyl]-4-chloro-3-nitro-benzenesulfonamide Formula: C29H31ClN4O6S2 MolecularWeight: 631.16264

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=C(N=C1SCCCNS(=O)(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-])C3=CC=C(C=C3)OC)C4=CC=C(C=C4)OC

Isomeric SMILES

CCCN1C(=C(N=C1SCCCNS(=O)(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-])C3=CC=C(C=C3)OC)C4=CC=C(C=C4)OC

InChI

InChI=1S/C29H31ClN4O6S2/c1-4-17-33-28(21-8-12-23(40-3)13-9-21)27(20-6-10-22(39-2)11-7-20)32-29(33)41-18-5-16-31-42(37,38)24-14-15-25(30)26(19-24)34(35)36/h6-15,19,31H,4-5,16-18H2,1-3H3