tert-butyl N-[N'-(naphthalen-1-ylmethyl)-N-piperazin-1-ylcarbonyl-carbamimidoyl]carbamate

Systemtic Name: tert-butyl N-[N'-(naphthalen-1-ylmethyl)-N-piperazin-1-ylcarbonyl-carbamimidoyl]carbamate Openeye Name: tert-butyl N-[N'-(1-naphthylmethyl)-N-(piperazine-1-carbonyl)carbamimidoyl]carbamate CAS Name: N-[1-naphthalenylmethylimino-[[oxo(1-piperazinyl)methyl]amino]methyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[N'-(naphthalen-1-ylmethyl)-N-(piperazine-1-carbonyl)carbamimidoyl]carbamate Traditional Name: N-[N'-(1-naphthylmethyl)-N-(piperazine-1-carbonyl)amidino]carbamic acid tert-butyl ester Formula: C22H29N5O3 MolecularWeight: 411.49736

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(=NCC1=CC=CC2=CC=CC=C21)NC(=O)N3CCNCC3

Isomeric SMILES

CC(C)(C)OC(=O)NC(=NCC1=CC=CC2=CC=CC=C21)NC(=O)N3CCNCC3

InChI

InChI=1S/C22H29N5O3/c1-22(2,3)30-21(29)26-19(25-20(28)27-13-11-23-12-14-27)24-15-17-9-6-8-16-7-4-5-10-18(16)17/h4-10,23H,11-15H2,1-3H3,(H2,24,25,26,28,29)