5-[[4-(2,4-dimethylphenyl)-1,3-thiazol-2-yl]amino]-5-oxidanylidene-pentanoate

Systemtic Name: 5-[[4-(2,4-dimethylphenyl)-1,3-thiazol-2-yl]amino]-5-oxidanylidene-pentanoate Openeye Name: 5-[[4-(2,4-dimethylphenyl)thiazol-2-yl]amino]-5-oxo-pentanoate CAS Name: 5-[[4-(2,4-dimethylphenyl)-2-thiazolyl]amino]-5-oxopentanoate IUPAC Name: 5-[[4-(2,4-dimethylphenyl)-1,3-thiazol-2-yl]amino]-5-oxopentanoate Traditional Name: 5-[[4-(2,4-dimethylphenyl)thiazol-2-yl]amino]-5-keto-valerate Formula: C16H17N2O3S- MolecularWeight: 317.38278

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C2=CSC(=N2)NC(=O)CCCC(=O)[O-])C

Isomeric SMILES

CC1=CC(=C(C=C1)C2=CSC(=N2)NC(=O)CCCC(=O)[O-])C

InChI

InChI=1S/C16H18N2O3S/c1-10-6-7-12(11(2)8-10)13-9-22-16(17-13)18-14(19)4-3-5-15(20)21/h6-9H,3-5H2,1-2H3,(H,20,21)(H,17,18,19)/p-1