tert-butyl N-[(3E)-3-(2-azanyl-4-oxidanylidene-1H-imidazol-5-ylidene)propyl]carbamate

Systemtic Name: tert-butyl N-[(3E)-3-(2-azanyl-4-oxidanylidene-1H-imidazol-5-ylidene)propyl]carbamate Openeye Name: tert-butyl N-[(3E)-3-(2-amino-4-oxo-1H-imidazol-5-ylidene)propyl]carbamate CAS Name: N-[(3E)-3-(2-amino-4-oxo-1H-imidazol-5-ylidene)propyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(3E)-3-(2-amino-4-oxo-1H-imidazol-5-ylidene)propyl]carbamate Traditional Name: N-[(3E)-3-(2-amino-5-keto-2-imidazolin-4-ylidene)propyl]carbamic acid tert-butyl ester Formula: C11H18N4O3 MolecularWeight: 254.28562

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCCC=C1C(=O)N=C(N1)N

Isomeric SMILES

CC(C)(C)OC(=O)NCC/C=C/1\C(=O)N=C(N1)N

InChI

InChI=1S/C11H18N4O3/c1-11(2,3)18-10(17)13-6-4-5-7-8(16)15-9(12)14-7/h5H,4,6H2,1-3H3,(H,13,17)(H3,12,14,15,16)/b7-5+