N-[(R)-cyano-[4-methoxy-3,5-bis(phenylmethoxy)phenyl]methyl]-4-methyl-benzenesulfinamide

Systemtic Name: N-[(R)-cyano-[4-methoxy-3,5-bis(phenylmethoxy)phenyl]methyl]-4-methyl-benzenesulfinamide Openeye Name: N-[(R)-cyano-(3,5-dibenzyloxy-4-methoxy-phenyl)methyl]-4-methyl-benzenesulfinamide CAS Name: N-[(R)-cyano-[4-methoxy-3,5-bis(phenylmethoxy)phenyl]methyl]-4-methylbenzenesulfinamide IUPAC Name: N-[(R)-cyano-[4-methoxy-3,5-bis(phenylmethoxy)phenyl]methyl]-4-methylbenzenesulfinamide Traditional Name: N-[(R)-cyano-(3,5-dibenzoxy-4-methoxy-phenyl)methyl]-4-methyl-benzenesulfinamide Formula: C30H28N2O4S MolecularWeight: 512.61932

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)NC(C#N)C2=CC(=C(C(=C2)OCC3=CC=CC=C3)OC)OCC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)[S@@](=O)N[C@@H](C#N)C2=CC(=C(C(=C2)OCC3=CC=CC=C3)OC)OCC4=CC=CC=C4

InChI

InChI=1S/C30H28N2O4S/c1-22-13-15-26(16-14-22)37(33)32-27(19-31)25-17-28(35-20-23-9-5-3-6-10-23)30(34-2)29(18-25)36-21-24-11-7-4-8-12-24/h3-18,27,32H,20-21H2,1-2H3/t27-,37+/m0/s1