3-[(2E)-2-[(2-morpholin-4-yl-4-phenyl-1,3-thiazol-5-yl)methylidene]hydrazinyl]benzoic acid

Systemtic Name: 3-[(2E)-2-[(2-morpholin-4-yl-4-phenyl-1,3-thiazol-5-yl)methylidene]hydrazinyl]benzoic acid Openeye Name: 3-[(2E)-2-[(2-morpholino-4-phenyl-thiazol-5-yl)methylene]hydrazino]benzoic acid CAS Name: 3-[(2E)-2-[[2-(4-morpholinyl)-4-phenyl-5-thiazolyl]methylidene]hydrazinyl]benzoic acid IUPAC Name: 3-[(2E)-2-[(2-morpholin-4-yl-4-phenyl-1,3-thiazol-5-yl)methylidene]hydrazinyl]benzoic acid Traditional Name: 3-[(N'E)-N'-[(2-morpholino-4-phenyl-thiazol-5-yl)methylene]hydrazino]benzoic acid Formula: C21H20N4O3S MolecularWeight: 408.4735

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=NC(=C(S2)C=NNC3=CC=CC(=C3)C(=O)O)C4=CC=CC=C4

Isomeric SMILES

C1COCCN1C2=NC(=C(S2)/C=N/NC3=CC=CC(=C3)C(=O)O)C4=CC=CC=C4

InChI

InChI=1S/C21H20N4O3S/c26-20(27)16-7-4-8-17(13-16)24-22-14-18-19(15-5-2-1-3-6-15)23-21(29-18)25-9-11-28-12-10-25/h1-8,13-14,24H,9-12H2,(H,26,27)/b22-14+