tert-butyl N-[3-[[cyano(methyl)carbamoyl]-pentyl-carbamoyl]phenyl]carbamate

Systemtic Name: tert-butyl N-[3-[[cyano(methyl)carbamoyl]-pentyl-carbamoyl]phenyl]carbamate Openeye Name: tert-butyl N-[3-[[cyano(methyl)carbamoyl]-pentyl-carbamoyl]phenyl]carbamate CAS Name: N-[3-[[[[cyano(methyl)amino]-oxomethyl]-pentylamino]-oxomethyl]phenyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[3-[[cyano(methyl)carbamoyl]-pentylcarbamoyl]phenyl]carbamate Traditional Name: N-[3-[amyl-[cyano(methyl)carbamoyl]carbamoyl]phenyl]carbamic acid tert-butyl ester Formula: C20H28N4O4 MolecularWeight: 388.46072

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(C(=O)C1=CC(=CC=C1)NC(=O)OC(C)(C)C)C(=O)N(C)C#N

Isomeric SMILES

CCCCCN(C(=O)C1=CC(=CC=C1)NC(=O)OC(C)(C)C)C(=O)N(C)C#N

InChI

InChI=1S/C20H28N4O4/c1-6-7-8-12-24(19(27)23(5)14-21)17(25)15-10-9-11-16(13-15)22-18(26)28-20(2,3)4/h9-11,13H,6-8,12H2,1-5H3,(H,22,26)