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

Systemtic Name: 6-[3-(3-imidazol-1-ylpropyl)-2-phenylimino-1,3-thiazol-4-yl]-4H-1,4-benzoxazin-3-one Openeye Name: 6-[3-(3-imidazol-1-ylpropyl)-2-phenylimino-thiazol-4-yl]-4H-1,4-benzoxazin-3-one CAS Name: 6-[3-[3-(1-imidazolyl)propyl]-2-phenylimino-4-thiazolyl]-4H-1,4-benzoxazin-3-one IUPAC Name: 6-[3-(3-imidazol-1-ylpropyl)-2-phenylimino-1,3-thiazol-4-yl]-4H-1,4-benzoxazin-3-one Traditional Name: 6-[3-(3-imidazol-1-ylpropyl)-2-phenylimino-4-thiazolin-4-yl]-4H-1,4-benzoxazin-3-one Formula: C23H21N5O2S MolecularWeight: 431.51014

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H21N5O2S/c29-22-14-30-21-8-7-17(13-19(21)26-22)20-15-31-23(25-18-5-2-1-3-6-18)28(20)11-4-10-27-12-9-24-16-27/h1-3,5-9,12-13,15-16H,4,10-11,14H2,(H,26,29)