[2-[3-chloranyl-4-(2-cyclopentylethanoylamino)phenyl]carbonylimino-1,3-thiazol-3-yl]methyl 2-azanyl-3-methyl-butanoate

Systemtic Name: [2-[3-chloranyl-4-(2-cyclopentylethanoylamino)phenyl]carbonylimino-1,3-thiazol-3-yl]methyl 2-azanyl-3-methyl-butanoate Openeye Name: [2-[3-chloro-4-[(2-cyclopentylacetyl)amino]benzoyl]iminothiazol-3-yl]methyl 2-amino-3-methyl-butanoate CAS Name: 2-amino-3-methylbutanoic acid [2-[[3-chloro-4-[(2-cyclopentyl-1-oxoethyl)amino]phenyl]-oxomethyl]imino-3-thiazolyl]methyl ester IUPAC Name: [2-[3-chloro-4-[(2-cyclopentylacetyl)amino]benzoyl]imino-1,3-thiazol-3-yl]methyl 2-amino-3-methylbutanoate Traditional Name: 2-amino-3-methyl-butyric acid [2-[3-chloro-4-[(2-cyclopentylacetyl)amino]benzoyl]imino-4-thiazolin-3-yl]methyl ester Formula: C23H29ClN4O4S MolecularWeight: 493.01876

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OCN1C=CSC1=NC(=O)C2=CC(=C(C=C2)NC(=O)CC3CCCC3)Cl)N

Isomeric SMILES

CC(C)C(C(=O)OCN1C=CSC1=NC(=O)C2=CC(=C(C=C2)NC(=O)CC3CCCC3)Cl)N

InChI

InChI=1S/C23H29ClN4O4S/c1-14(2)20(25)22(31)32-13-28-9-10-33-23(28)27-21(30)16-7-8-18(17(24)12-16)26-19(29)11-15-5-3-4-6-15/h7-10,12,14-15,20H,3-6,11,13,25H2,1-2H3,(H,26,29)