tert-butyl N-[4-[[5-aminocarbonyl-1-(phenylmethyl)imidazol-4-yl]carbamoyl]phenyl]carbamate

Systemtic Name: tert-butyl N-[4-[[5-aminocarbonyl-1-(phenylmethyl)imidazol-4-yl]carbamoyl]phenyl]carbamate Openeye Name: tert-butyl N-[4-[(1-benzyl-5-carbamoyl-imidazol-4-yl)carbamoyl]phenyl]carbamate CAS Name: N-[4-[[[5-carbamoyl-1-(phenylmethyl)-4-imidazolyl]amino]-oxomethyl]phenyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[4-[(1-benzyl-5-carbamoylimidazol-4-yl)carbamoyl]phenyl]carbamate Traditional Name: N-[4-[(1-benzyl-5-carbamoyl-imidazol-4-yl)carbamoyl]phenyl]carbamic acid tert-butyl ester Formula: C23H25N5O4 MolecularWeight: 435.4757

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1=CC=C(C=C1)C(=O)NC2=C(N(C=N2)CC3=CC=CC=C3)C(=O)N

Isomeric SMILES

CC(C)(C)OC(=O)NC1=CC=C(C=C1)C(=O)NC2=C(N(C=N2)CC3=CC=CC=C3)C(=O)N

InChI

InChI=1S/C23H25N5O4/c1-23(2,3)32-22(31)26-17-11-9-16(10-12-17)21(30)27-20-18(19(24)29)28(14-25-20)13-15-7-5-4-6-8-15/h4-12,14H,13H2,1-3H3,(H2,24,29)(H,26,31)(H,27,30)