N-[4-(cyanomethyl)phenyl]-4-oxidanylidene-4-(4-pentoxyphenyl)-N-propan-2-ylsulfonyl-butanamide

Systemtic Name: N-[4-(cyanomethyl)phenyl]-4-oxidanylidene-4-(4-pentoxyphenyl)-N-propan-2-ylsulfonyl-butanamide Openeye Name: N-[4-(cyanomethyl)phenyl]-N-isopropylsulfonyl-4-oxo-4-(4-pentoxyphenyl)butanamide CAS Name: N-[4-(cyanomethyl)phenyl]-4-oxo-4-(4-pentoxyphenyl)-N-propan-2-ylsulfonylbutanamide IUPAC Name: N-[4-(cyanomethyl)phenyl]-4-oxo-4-(4-pentoxyphenyl)-N-propan-2-ylsulfonylbutanamide Traditional Name: 4-(4-amoxyphenyl)-N-[4-(cyanomethyl)phenyl]-N-isopropylsulfonyl-4-keto-butyramide Formula: C26H32N2O5S MolecularWeight: 484.60768

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=C(C=C1)C(=O)CCC(=O)N(C2=CC=C(C=C2)CC#N)S(=O)(=O)C(C)C

Isomeric SMILES

CCCCCOC1=CC=C(C=C1)C(=O)CCC(=O)N(C2=CC=C(C=C2)CC#N)S(=O)(=O)C(C)C

InChI

InChI=1S/C26H32N2O5S/c1-4-5-6-19-33-24-13-9-22(10-14-24)25(29)15-16-26(30)28(34(31,32)20(2)3)23-11-7-21(8-12-23)17-18-27/h7-14,20H,4-6,15-17,19H2,1-3H3