methyl 6-[[2-[(4-chlorophenyl)sulfonylamino]-3-imidazol-1-yl-propanoyl]amino]hexanoate

Systemtic Name: methyl 6-[[2-[(4-chlorophenyl)sulfonylamino]-3-imidazol-1-yl-propanoyl]amino]hexanoate Openeye Name: methyl 6-[[2-[(4-chlorophenyl)sulfonylamino]-3-imidazol-1-yl-propanoyl]amino]hexanoate CAS Name: 6-[[2-[(4-chlorophenyl)sulfonylamino]-3-(1-imidazolyl)-1-oxopropyl]amino]hexanoic acid methyl ester IUPAC Name: methyl 6-[[2-[(4-chlorophenyl)sulfonylamino]-3-imidazol-1-ylpropanoyl]amino]hexanoate Traditional Name: 6-[[2-[(4-chlorophenyl)sulfonylamino]-3-imidazol-1-yl-propanoyl]amino]hexanoic acid methyl ester Formula: C19H25ClN4O5S MolecularWeight: 456.9436

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCCCNC(=O)C(CN1C=CN=C1)NS(=O)(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

COC(=O)CCCCCNC(=O)C(CN1C=CN=C1)NS(=O)(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C19H25ClN4O5S/c1-29-18(25)5-3-2-4-10-22-19(26)17(13-24-12-11-21-14-24)23-30(27,28)16-8-6-15(20)7-9-16/h6-9,11-12,14,17,23H,2-5,10,13H2,1H3,(H,22,26)