methyl 5-[[2-[(4-chlorophenyl)sulfonylamino]-3-imidazol-1-yl-propanoyl]amino]pentanoate

Systemtic Name: methyl 5-[[2-[(4-chlorophenyl)sulfonylamino]-3-imidazol-1-yl-propanoyl]amino]pentanoate Openeye Name: methyl 5-[[2-[(4-chlorophenyl)sulfonylamino]-3-imidazol-1-yl-propanoyl]amino]pentanoate CAS Name: 5-[[2-[(4-chlorophenyl)sulfonylamino]-3-(1-imidazolyl)-1-oxopropyl]amino]pentanoic acid methyl ester IUPAC Name: methyl 5-[[2-[(4-chlorophenyl)sulfonylamino]-3-imidazol-1-ylpropanoyl]amino]pentanoate Traditional Name: 5-[[2-[(4-chlorophenyl)sulfonylamino]-3-imidazol-1-yl-propanoyl]amino]valeric acid methyl ester Formula: C18H23ClN4O5S MolecularWeight: 442.91702

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H23ClN4O5S/c1-28-17(24)4-2-3-9-21-18(25)16(12-23-11-10-20-13-23)22-29(26,27)15-7-5-14(19)6-8-15/h5-8,10-11,13,16,22H,2-4,9,12H2,1H3,(H,21,25)