4-[4-cyano-5-[4-(diphenylmethyl)piperazin-1-yl]-1,3-oxazol-2-yl]-N,N-diethyl-benzenesulfonamide

Systemtic Name: 4-[4-cyano-5-[4-(diphenylmethyl)piperazin-1-yl]-1,3-oxazol-2-yl]-N,N-diethyl-benzenesulfonamide Openeye Name: 4-[5-(4-benzhydrylpiperazin-1-yl)-4-cyano-oxazol-2-yl]-N,N-diethyl-benzenesulfonamide CAS Name: 4-[4-cyano-5-[4-(diphenylmethyl)-1-piperazinyl]-2-oxazolyl]-N,N-diethylbenzenesulfonamide IUPAC Name: 4-[5-(4-benzhydrylpiperazin-1-yl)-4-cyano-1,3-oxazol-2-yl]-N,N-diethylbenzenesulfonamide Traditional Name: 4-[5-(4-benzhydrylpiperazino)-4-cyano-oxazol-2-yl]-N,N-diethyl-benzenesulfonamide Formula: C31H33N5O3S MolecularWeight: 555.69042

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)C2=NC(=C(O2)N3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5)C#N

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)C2=NC(=C(O2)N3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5)C#N

InChI

InChI=1S/C31H33N5O3S/c1-3-36(4-2)40(37,38)27-17-15-26(16-18-27)30-33-28(23-32)31(39-30)35-21-19-34(20-22-35)29(24-11-7-5-8-12-24)25-13-9-6-10-14-25/h5-18,29H,3-4,19-22H2,1-2H3