(3Z)-3-(4-bromanyl-6-isocyano-1,3-dihydrobenzimidazol-2-ylidene)-4-[(1-oxidanyl-3-phenyl-propan-2-yl)amino]pyridin-2-one

Systemtic Name: (3Z)-3-(4-bromanyl-6-isocyano-1,3-dihydrobenzimidazol-2-ylidene)-4-[(1-oxidanyl-3-phenyl-propan-2-yl)amino]pyridin-2-one Openeye Name: (3Z)-4-[(1-benzyl-2-hydroxy-ethyl)amino]-3-(4-bromo-6-isocyano-1,3-dihydrobenzimidazol-2-ylidene)pyridin-2-one CAS Name: (3Z)-3-(4-bromo-6-isocyano-1,3-dihydrobenzimidazol-2-ylidene)-4-[(1-hydroxy-3-phenylpropan-2-yl)amino]-2-pyridinone IUPAC Name: (3Z)-3-(4-bromo-6-isocyano-1,3-dihydrobenzimidazol-2-ylidene)-4-[(1-hydroxy-3-phenylpropan-2-yl)amino]pyridin-2-one Traditional Name: (3Z)-4-[(1-benzyl-2-hydroxy-ethyl)amino]-3-(4-bromo-6-isocyano-1,3-dihydrobenzimidazol-2-ylidene)-2-pyridone Formula: C22H18BrN5O2 MolecularWeight: 464.31462

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Descriptors Computed from Structure

Canonical SMILES:

[C-]#[N+]C1=CC2=C(C(=C1)Br)NC(=C3C(=CC=NC3=O)NC(CC4=CC=CC=C4)CO)N2

Isomeric SMILES

[C-]#[N+]C1=CC2=C(C(=C1)Br)N/C(=C\3/C(=CC=NC3=O)NC(CC4=CC=CC=C4)CO)/N2

InChI

InChI=1S/C22H18BrN5O2/c1-24-14-10-16(23)20-18(11-14)27-21(28-20)19-17(7-8-25-22(19)30)26-15(12-29)9-13-5-3-2-4-6-13/h2-8,10-11,15,26-29H,9,12H2/b21-19-