tert-butyl N-[(5-carbamimidoyl-1-methyl-pyrrol-2-yl)methyl]carbamate

Systemtic Name: tert-butyl N-[(5-carbamimidoyl-1-methyl-pyrrol-2-yl)methyl]carbamate Openeye Name: tert-butyl N-[(5-carbamimidoyl-1-methyl-pyrrol-2-yl)methyl]carbamate CAS Name: N-[(5-carbamimidoyl-1-methyl-2-pyrrolyl)methyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(5-carbamimidoyl-1-methylpyrrol-2-yl)methyl]carbamate Traditional Name: N-[(5-amidino-1-methyl-pyrrol-2-yl)methyl]carbamic acid tert-butyl ester Formula: C12H20N4O2 MolecularWeight: 252.3128

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCC1=CC=C(N1C)C(=N)N

Isomeric SMILES

CC(C)(C)OC(=O)NCC1=CC=C(N1C)C(=N)N

InChI

InChI=1S/C12H20N4O2/c1-12(2,3)18-11(17)15-7-8-5-6-9(10(13)14)16(8)4/h5-6H,7H2,1-4H3,(H3,13,14)(H,15,17)