4-chloranyl-N-[3-[4-(diphenylmethyl)piperazin-1-yl]-3-oxidanylidene-propyl]-N-(furan-2-ylmethyl)-3-nitro-benzenesulfonamide

Systemtic Name: 4-chloranyl-N-[3-[4-(diphenylmethyl)piperazin-1-yl]-3-oxidanylidene-propyl]-N-(furan-2-ylmethyl)-3-nitro-benzenesulfonamide Openeye Name: N-[3-(4-benzhydrylpiperazin-1-yl)-3-oxo-propyl]-4-chloro-N-(2-furylmethyl)-3-nitro-benzenesulfonamide CAS Name: 4-chloro-N-[3-[4-(diphenylmethyl)-1-piperazinyl]-3-oxopropyl]-N-(2-furanylmethyl)-3-nitrobenzenesulfonamide IUPAC Name: N-[3-(4-benzhydrylpiperazin-1-yl)-3-oxopropyl]-4-chloro-N-(furan-2-ylmethyl)-3-nitrobenzenesulfonamide Traditional Name: N-[3-(4-benzhydrylpiperazino)-3-keto-propyl]-4-chloro-N-(2-furfuryl)-3-nitro-benzenesulfonamide Formula: C31H31ClN4O6S MolecularWeight: 623.11904

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)CCN(CC4=CC=CO4)S(=O)(=O)C5=CC(=C(C=C5)Cl)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)CCN(CC4=CC=CO4)S(=O)(=O)C5=CC(=C(C=C5)Cl)[N+](=O)[O-]

InChI

InChI=1S/C31H31ClN4O6S/c32-28-14-13-27(22-29(28)36(38)39)43(40,41)35(23-26-12-7-21-42-26)16-15-30(37)33-17-19-34(20-18-33)31(24-8-3-1-4-9-24)25-10-5-2-6-11-25/h1-14,21-22,31H,15-20,23H2