tert-butyl N-[N'-(3-imidazol-1-ylpropyl)-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamimidoyl]carbamate

Systemtic Name: tert-butyl N-[N'-(3-imidazol-1-ylpropyl)-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamimidoyl]carbamate Openeye Name: tert-butyl N-[N-tert-butoxycarbonyl-N'-(3-imidazol-1-ylpropyl)carbamimidoyl]carbamate CAS Name: N-[3-(1-imidazolyl)propylimino-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]methyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[N'-(3-imidazol-1-ylpropyl)-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamimidoyl]carbamate Traditional Name: N-[N-tert-butoxycarbonyl-N'-(3-imidazol-1-ylpropyl)amidino]carbamic acid tert-butyl ester Formula: C17H29N5O4 MolecularWeight: 367.44326

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(=NCCCN1C=CN=C1)NC(=O)OC(C)(C)C

Isomeric SMILES

CC(C)(C)OC(=O)NC(=NCCCN1C=CN=C1)NC(=O)OC(C)(C)C

InChI

InChI=1S/C17H29N5O4/c1-16(2,3)25-14(23)20-13(21-15(24)26-17(4,5)6)19-8-7-10-22-11-9-18-12-22/h9,11-12H,7-8,10H2,1-6H3,(H2,19,20,21,23,24)