2-[[6-(3-imidazol-1-ylpropylamino)pyridin-2-yl]amino]-N-phenyl-1,3-thiazole-5-carboxamide

Systemtic Name: 2-[[6-(3-imidazol-1-ylpropylamino)pyridin-2-yl]amino]-N-phenyl-1,3-thiazole-5-carboxamide Openeye Name: 2-[[6-(3-imidazol-1-ylpropylamino)-2-pyridyl]amino]-N-phenyl-thiazole-5-carboxamide CAS Name: 2-[[6-[3-(1-imidazolyl)propylamino]-2-pyridinyl]amino]-N-phenyl-5-thiazolecarboxamide IUPAC Name: 2-[[6-(3-imidazol-1-ylpropylamino)pyridin-2-yl]amino]-N-phenyl-1,3-thiazole-5-carboxamide Traditional Name: 2-[[6-(3-imidazol-1-ylpropylamino)-2-pyridyl]amino]-N-phenyl-thiazole-5-carboxamide Formula: C21H21N7OS MolecularWeight: 419.50274

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)C2=CN=C(S2)NC3=NC(=CC=C3)NCCCN4C=CN=C4

Isomeric SMILES

C1=CC=C(C=C1)NC(=O)C2=CN=C(S2)NC3=NC(=CC=C3)NCCCN4C=CN=C4

InChI

InChI=1S/C21H21N7OS/c29-20(25-16-6-2-1-3-7-16)17-14-24-21(30-17)27-19-9-4-8-18(26-19)23-10-5-12-28-13-11-22-15-28/h1-4,6-9,11,13-15H,5,10,12H2,(H,25,29)(H2,23,24,26,27)