3-phenylbutyl N-[2-[4,5-bis(chloranyl)imidazol-1-yl]ethanoylamino]carbamate

Systemtic Name: 3-phenylbutyl N-[2-[4,5-bis(chloranyl)imidazol-1-yl]ethanoylamino]carbamate Openeye Name: 3-phenylbutyl N-[[2-(4,5-dichloroimidazol-1-yl)acetyl]amino]carbamate CAS Name: N-[[2-(4,5-dichloro-1-imidazolyl)-1-oxoethyl]amino]carbamic acid 3-phenylbutyl ester IUPAC Name: 3-phenylbutyl N-[[2-(4,5-dichloroimidazol-1-yl)acetyl]amino]carbamate Traditional Name: N-[[2-(4,5-dichloroimidazol-1-yl)acetyl]amino]carbamic acid 3-phenylbutyl ester Formula: C16H18Cl2N4O3 MolecularWeight: 385.24512

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CCOC(=O)NNC(=O)CN1C=NC(=C1Cl)Cl)C2=CC=CC=C2

Isomeric SMILES

CC(CCOC(=O)NNC(=O)CN1C=NC(=C1Cl)Cl)C2=CC=CC=C2

InChI

InChI=1S/C16H18Cl2N4O3/c1-11(12-5-3-2-4-6-12)7-8-25-16(24)21-20-13(23)9-22-10-19-14(17)15(22)18/h2-6,10-11H,7-9H2,1H3,(H,20,23)(H,21,24)