6-[3-(3-imidazol-1-ylpropyl)-2-pyridin-3-ylimino-1,3-thiazol-4-yl]-4H-1,4-benzoxazin-3-one

Systemtic Name: 6-[3-(3-imidazol-1-ylpropyl)-2-pyridin-3-ylimino-1,3-thiazol-4-yl]-4H-1,4-benzoxazin-3-one Openeye Name: 6-[3-(3-imidazol-1-ylpropyl)-2-(3-pyridylimino)thiazol-4-yl]-4H-1,4-benzoxazin-3-one CAS Name: 6-[3-[3-(1-imidazolyl)propyl]-2-(3-pyridinylimino)-4-thiazolyl]-4H-1,4-benzoxazin-3-one IUPAC Name: 6-[3-(3-imidazol-1-ylpropyl)-2-pyridin-3-ylimino-1,3-thiazol-4-yl]-4H-1,4-benzoxazin-3-one Traditional Name: 6-[3-(3-imidazol-1-ylpropyl)-2-(3-pyridylimino)-4-thiazolin-4-yl]-4H-1,4-benzoxazin-3-one Formula: C22H20N6O2S MolecularWeight: 432.4982

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)NC2=C(O1)C=CC(=C2)C3=CSC(=NC4=CN=CC=C4)N3CCCN5C=CN=C5

Isomeric SMILES

C1C(=O)NC2=C(O1)C=CC(=C2)C3=CSC(=NC4=CN=CC=C4)N3CCCN5C=CN=C5

InChI

InChI=1S/C22H20N6O2S/c29-21-13-30-20-5-4-16(11-18(20)26-21)19-14-31-22(25-17-3-1-6-23-12-17)28(19)9-2-8-27-10-7-24-15-27/h1,3-7,10-12,14-15H,2,8-9,13H2,(H,26,29)