tert-butyl N-[(5E)-5-(1,5-naphthyridin-2-ylmethylidene)-4-oxidanylidene-1H-imidazol-2-yl]carbamate

Systemtic Name: tert-butyl N-[(5E)-5-(1,5-naphthyridin-2-ylmethylidene)-4-oxidanylidene-1H-imidazol-2-yl]carbamate Openeye Name: tert-butyl N-[(5E)-5-(1,5-naphthyridin-2-ylmethylene)-4-oxo-1H-imidazol-2-yl]carbamate CAS Name: N-[(5E)-5-(1,5-naphthyridin-2-ylmethylidene)-4-oxo-1H-imidazol-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(5E)-5-(1,5-naphthyridin-2-ylmethylidene)-4-oxo-1H-imidazol-2-yl]carbamate Traditional Name: N-[(5E)-4-keto-5-(1,5-naphthyridin-2-ylmethylene)-2-imidazolin-2-yl]carbamic acid tert-butyl ester Formula: C17H17N5O3 MolecularWeight: 339.34858

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1=NC(=O)C(=CC2=NC3=C(C=C2)N=CC=C3)N1

Isomeric SMILES

CC(C)(C)OC(=O)NC1=NC(=O)/C(=C\C2=NC3=C(C=C2)N=CC=C3)/N1

InChI

InChI=1S/C17H17N5O3/c1-17(2,3)25-16(24)22-15-20-13(14(23)21-15)9-10-6-7-11-12(19-10)5-4-8-18-11/h4-9H,1-3H3,(H2,20,21,22,23,24)/b13-9+