tert-butyl N-[3-[[(4-cyanophenyl)carbamoylamino]methyl]phenyl]carbamate

Systemtic Name: tert-butyl N-[3-[[(4-cyanophenyl)carbamoylamino]methyl]phenyl]carbamate Openeye Name: tert-butyl N-[3-[[(4-cyanophenyl)carbamoylamino]methyl]phenyl]carbamate CAS Name: N-[3-[[[(4-cyanoanilino)-oxomethyl]amino]methyl]phenyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[3-[[(4-cyanophenyl)carbamoylamino]methyl]phenyl]carbamate Traditional Name: N-[3-[[(4-cyanophenyl)carbamoylamino]methyl]phenyl]carbamic acid tert-butyl ester Formula: C20H22N4O3 MolecularWeight: 366.41368

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1=CC=CC(=C1)CNC(=O)NC2=CC=C(C=C2)C#N

Isomeric SMILES

CC(C)(C)OC(=O)NC1=CC=CC(=C1)CNC(=O)NC2=CC=C(C=C2)C#N

InChI

InChI=1S/C20H22N4O3/c1-20(2,3)27-19(26)24-17-6-4-5-15(11-17)13-22-18(25)23-16-9-7-14(12-21)8-10-16/h4-11H,13H2,1-3H3,(H,24,26)(H2,22,23,25)