tert-butyl N-[3-[[5-aminocarbonyl-1-(phenylmethyl)imidazol-4-yl]amino]-3-oxidanylidene-propyl]-N-methyl-carbamate

Systemtic Name: tert-butyl N-[3-[[5-aminocarbonyl-1-(phenylmethyl)imidazol-4-yl]amino]-3-oxidanylidene-propyl]-N-methyl-carbamate Openeye Name: tert-butyl N-[3-[(1-benzyl-5-carbamoyl-imidazol-4-yl)amino]-3-oxo-propyl]-N-methyl-carbamate CAS Name: N-[3-[[5-carbamoyl-1-(phenylmethyl)-4-imidazolyl]amino]-3-oxopropyl]-N-methylcarbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[3-[(1-benzyl-5-carbamoylimidazol-4-yl)amino]-3-oxopropyl]-N-methylcarbamate Traditional Name: N-[3-[(1-benzyl-5-carbamoyl-imidazol-4-yl)amino]-3-keto-propyl]-N-methyl-carbamic acid tert-butyl ester Formula: C20H27N5O4 MolecularWeight: 401.45948

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N(C)CCC(=O)NC1=C(N(C=N1)CC2=CC=CC=C2)C(=O)N

Isomeric SMILES

CC(C)(C)OC(=O)N(C)CCC(=O)NC1=C(N(C=N1)CC2=CC=CC=C2)C(=O)N

InChI

InChI=1S/C20H27N5O4/c1-20(2,3)29-19(28)24(4)11-10-15(26)23-18-16(17(21)27)25(13-22-18)12-14-8-6-5-7-9-14/h5-9,13H,10-12H2,1-4H3,(H2,21,27)(H,23,26)