(4S)-5-(dipropylamino)-4-[(4-methylphenyl)sulfonylamino]-5-oxidanylidene-pentanoic acid

Systemtic Name: (4S)-5-(dipropylamino)-4-[(4-methylphenyl)sulfonylamino]-5-oxidanylidene-pentanoic acid Openeye Name: (4S)-5-(dipropylamino)-5-oxo-4-(p-tolylsulfonylamino)pentanoic acid CAS Name: (4S)-5-(dipropylamino)-4-[(4-methylphenyl)sulfonylamino]-5-oxopentanoic acid IUPAC Name: (4S)-5-(dipropylamino)-4-[(4-methylphenyl)sulfonylamino]-5-oxopentanoic acid Traditional Name: (4S)-5-(dipropylamino)-5-keto-4-(tosylamino)valeric acid Formula: C18H28N2O5S MolecularWeight: 384.49032

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC)C(=O)C(CCC(=O)O)NS(=O)(=O)C1=CC=C(C=C1)C

Isomeric SMILES

CCCN(CCC)C(=O)[C@H](CCC(=O)O)NS(=O)(=O)C1=CC=C(C=C1)C

InChI

InChI=1S/C18H28N2O5S/c1-4-12-20(13-5-2)18(23)16(10-11-17(21)22)19-26(24,25)15-8-6-14(3)7-9-15/h6-9,16,19H,4-5,10-13H2,1-3H3,(H,21,22)/t16-/m0/s1