4-[[2-(diethylamino)-1,3-thiazol-5-yl]methylamino]benzoic acid

Systemtic Name: 4-[[2-(diethylamino)-1,3-thiazol-5-yl]methylamino]benzoic acid Openeye Name: 4-[[2-(diethylamino)thiazol-5-yl]methylamino]benzoic acid CAS Name: 4-[[2-(diethylamino)-5-thiazolyl]methylamino]benzoic acid IUPAC Name: 4-[[2-(diethylamino)-1,3-thiazol-5-yl]methylamino]benzoic acid Traditional Name: 4-[[2-(diethylamino)thiazol-5-yl]methylamino]benzoic acid Formula: C15H19N3O2S MolecularWeight: 305.39526

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=NC=C(S1)CNC2=CC=C(C=C2)C(=O)O

Isomeric SMILES

CCN(CC)C1=NC=C(S1)CNC2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C15H19N3O2S/c1-3-18(4-2)15-17-10-13(21-15)9-16-12-7-5-11(6-8-12)14(19)20/h5-8,10,16H,3-4,9H2,1-2H3,(H,19,20)