4-piperazin-1-yl-3-[(2-thiophen-2-yl-1,3-thiazol-4-yl)carbonylamino]benzoic acid

Systemtic Name: 4-piperazin-1-yl-3-[(2-thiophen-2-yl-1,3-thiazol-4-yl)carbonylamino]benzoic acid Openeye Name: 4-piperazin-1-yl-3-[[2-(2-thienyl)thiazole-4-carbonyl]amino]benzoic acid CAS Name: 3-[[oxo-(2-thiophen-2-yl-4-thiazolyl)methyl]amino]-4-(1-piperazinyl)benzoic acid IUPAC Name: 4-piperazin-1-yl-3-[(2-thiophen-2-yl-1,3-thiazole-4-carbonyl)amino]benzoic acid Traditional Name: 4-piperazino-3-[[2-(2-thienyl)thiazole-4-carbonyl]amino]benzoic acid Formula: C19H18N4O3S2 MolecularWeight: 414.50122

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2=C(C=C(C=C2)C(=O)O)NC(=O)C3=CSC(=N3)C4=CC=CS4

Isomeric SMILES

C1CN(CCN1)C2=C(C=C(C=C2)C(=O)O)NC(=O)C3=CSC(=N3)C4=CC=CS4

InChI

InChI=1S/C19H18N4O3S2/c24-17(14-11-28-18(22-14)16-2-1-9-27-16)21-13-10-12(19(25)26)3-4-15(13)23-7-5-20-6-8-23/h1-4,9-11,20H,5-8H2,(H,21,24)(H,25,26)