3-[(1-cyclopropyl-5-phenyl-imidazol-2-yl)sulfanylmethyl]-1,2,3-benzotriazin-4-one

Systemtic Name: 3-[(1-cyclopropyl-5-phenyl-imidazol-2-yl)sulfanylmethyl]-1,2,3-benzotriazin-4-one Openeye Name: 3-[(1-cyclopropyl-5-phenyl-imidazol-2-yl)sulfanylmethyl]-1,2,3-benzotriazin-4-one CAS Name: 3-[[(1-cyclopropyl-5-phenyl-2-imidazolyl)thio]methyl]-1,2,3-benzotriazin-4-one IUPAC Name: 3-[(1-cyclopropyl-5-phenylimidazol-2-yl)sulfanylmethyl]-1,2,3-benzotriazin-4-one Traditional Name: 3-[[(1-cyclopropyl-5-phenyl-imidazol-2-yl)thio]methyl]-1,2,3-benzotriazin-4-one Formula: C20H17N5OS MolecularWeight: 375.44688

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C(=CN=C2SCN3C(=O)C4=CC=CC=C4N=N3)C5=CC=CC=C5

Isomeric SMILES

C1CC1N2C(=CN=C2SCN3C(=O)C4=CC=CC=C4N=N3)C5=CC=CC=C5

InChI

InChI=1S/C20H17N5OS/c26-19-16-8-4-5-9-17(16)22-23-24(19)13-27-20-21-12-18(25(20)15-10-11-15)14-6-2-1-3-7-14/h1-9,12,15H,10-11,13H2