2-[3-methylbutyl-(4-methylphenyl)sulfonyl-amino]-N-[(6-methyl-4-oxidanylidene-chromen-3-yl)methyl]-N-(phenylmethyl)ethanamide

Systemtic Name: 2-[3-methylbutyl-(4-methylphenyl)sulfonyl-amino]-N-[(6-methyl-4-oxidanylidene-chromen-3-yl)methyl]-N-(phenylmethyl)ethanamide Openeye Name: N-benzyl-2-[isopentyl(p-tolylsulfonyl)amino]-N-[(6-methyl-4-oxo-chromen-3-yl)methyl]acetamide CAS Name: 2-[3-methylbutyl-(4-methylphenyl)sulfonylamino]-N-[(6-methyl-4-oxo-1-benzopyran-3-yl)methyl]-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-2-[3-methylbutyl-(4-methylphenyl)sulfonylamino]-N-[(6-methyl-4-oxochromen-3-yl)methyl]acetamide Traditional Name: N-benzyl-2-[isoamyl(tosyl)amino]-N-[(4-keto-6-methyl-chromen-3-yl)methyl]acetamide Formula: C32H36N2O5S MolecularWeight: 560.70364

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CCC(C)C)CC(=O)N(CC2=CC=CC=C2)CC3=COC4=C(C3=O)C=C(C=C4)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CCC(C)C)CC(=O)N(CC2=CC=CC=C2)CC3=COC4=C(C3=O)C=C(C=C4)C

InChI

InChI=1S/C32H36N2O5S/c1-23(2)16-17-34(40(37,38)28-13-10-24(3)11-14-28)21-31(35)33(19-26-8-6-5-7-9-26)20-27-22-39-30-15-12-25(4)18-29(30)32(27)36/h5-15,18,22-23H,16-17,19-21H2,1-4H3