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

Systemtic Name: 5-[[4-(4-butylphenyl)-5-methyl-1,3-thiazol-2-yl]amino]-5-oxidanylidene-pentanoate Openeye Name: 5-[[4-(4-butylphenyl)-5-methyl-thiazol-2-yl]amino]-5-oxo-pentanoate CAS Name: 5-[[4-(4-butylphenyl)-5-methyl-2-thiazolyl]amino]-5-oxopentanoate IUPAC Name: 5-[[4-(4-butylphenyl)-5-methyl-1,3-thiazol-2-yl]amino]-5-oxopentanoate Traditional Name: 5-[[4-(4-butylphenyl)-5-methyl-thiazol-2-yl]amino]-5-keto-valerate Formula: C19H23N2O3S- MolecularWeight: 359.46252

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C2=C(SC(=N2)NC(=O)CCCC(=O)[O-])C

Isomeric SMILES

CCCCC1=CC=C(C=C1)C2=C(SC(=N2)NC(=O)CCCC(=O)[O-])C

InChI

InChI=1S/C19H24N2O3S/c1-3-4-6-14-9-11-15(12-10-14)18-13(2)25-19(21-18)20-16(22)7-5-8-17(23)24/h9-12H,3-8H2,1-2H3,(H,23,24)(H,20,21,22)/p-1