4-[6-oxidanylidene-2-phenyl-3-(2-propan-2-ylphenyl)sulfanyl-3H-pyran-2-yl]-N-(phenylmethyl)butane-1-sulfonamide

Systemtic Name: 4-[6-oxidanylidene-2-phenyl-3-(2-propan-2-ylphenyl)sulfanyl-3H-pyran-2-yl]-N-(phenylmethyl)butane-1-sulfonamide Openeye Name: N-benzyl-4-[3-(2-isopropylphenyl)sulfanyl-6-oxo-2-phenyl-3H-pyran-2-yl]butane-1-sulfonamide CAS Name: 4-[6-oxo-2-phenyl-3-[(2-propan-2-ylphenyl)thio]-3H-pyran-2-yl]-N-(phenylmethyl)-1-butanesulfonamide IUPAC Name: N-benzyl-4-[6-oxo-2-phenyl-3-(2-propan-2-ylphenyl)sulfanyl-3H-pyran-2-yl]butane-1-sulfonamide Traditional Name: N-benzyl-4-[6-keto-3-(o-cumenylthio)-2-phenyl-3H-pyran-2-yl]butane-1-sulfonamide Formula: C31H35NO4S2 MolecularWeight: 549.7439

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=C1SC2C=CC(=O)OC2(CCCCS(=O)(=O)NCC3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC(C)C1=CC=CC=C1SC2C=CC(=O)OC2(CCCCS(=O)(=O)NCC3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C31H35NO4S2/c1-24(2)27-17-9-10-18-28(27)37-29-19-20-30(33)36-31(29,26-15-7-4-8-16-26)21-11-12-22-38(34,35)32-23-25-13-5-3-6-14-25/h3-10,13-20,24,29,32H,11-12,21-23H2,1-2H3