3-phenylpropyl 5-[[4-[methyl-(phenylmethyl)sulfamoyl]phenyl]amino]-5-oxidanylidene-pentanoate

Systemtic Name: 3-phenylpropyl 5-[[4-[methyl-(phenylmethyl)sulfamoyl]phenyl]amino]-5-oxidanylidene-pentanoate Openeye Name: 3-phenylpropyl 5-[4-[benzyl(methyl)sulfamoyl]anilino]-5-oxo-pentanoate CAS Name: 5-[4-[methyl-(phenylmethyl)sulfamoyl]anilino]-5-oxopentanoic acid 3-phenylpropyl ester IUPAC Name: 3-phenylpropyl 5-[4-[benzyl(methyl)sulfamoyl]anilino]-5-oxopentanoate Traditional Name: 5-[4-[benzyl(methyl)sulfamoyl]anilino]-5-keto-valeric acid 3-phenylpropyl ester Formula: C28H32N2O5S MolecularWeight: 508.62908

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)CCCC(=O)OCCCC3=CC=CC=C3

Isomeric SMILES

CN(CC1=CC=CC=C1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)CCCC(=O)OCCCC3=CC=CC=C3

InChI

InChI=1S/C28H32N2O5S/c1-30(22-24-12-6-3-7-13-24)36(33,34)26-19-17-25(18-20-26)29-27(31)15-8-16-28(32)35-21-9-14-23-10-4-2-5-11-23/h2-7,10-13,17-20H,8-9,14-16,21-22H2,1H3,(H,29,31)