4-[5-[2-(butanoylamino)-1,3-thiazol-4-yl]thiophen-2-yl]benzoic acid

Systemtic Name: 4-[5-[2-(butanoylamino)-1,3-thiazol-4-yl]thiophen-2-yl]benzoic acid Openeye Name: 4-[5-[2-(butanoylamino)thiazol-4-yl]-2-thienyl]benzoic acid CAS Name: 4-[5-[2-(1-oxobutylamino)-4-thiazolyl]-2-thiophenyl]benzoic acid IUPAC Name: 4-[5-[2-(butanoylamino)-1,3-thiazol-4-yl]thiophen-2-yl]benzoic acid Traditional Name: 4-[5-(2-butyramidothiazol-4-yl)-2-thienyl]benzoic acid Formula: C18H16N2O3S2 MolecularWeight: 372.46124

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=NC(=CS1)C2=CC=C(S2)C3=CC=C(C=C3)C(=O)O

Isomeric SMILES

CCCC(=O)NC1=NC(=CS1)C2=CC=C(S2)C3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C18H16N2O3S2/c1-2-3-16(21)20-18-19-13(10-24-18)15-9-8-14(25-15)11-4-6-12(7-5-11)17(22)23/h4-10H,2-3H2,1H3,(H,22,23)(H,19,20,21)