1-cyanobutan-2-yl N-[(1R)-1-[3-[(4-cyano-3-methoxy-phenyl)carbamoylamino]phenyl]ethyl]carbamate

Systemtic Name: 1-cyanobutan-2-yl N-[(1R)-1-[3-[(4-cyano-3-methoxy-phenyl)carbamoylamino]phenyl]ethyl]carbamate Openeye Name: 1-(cyanomethyl)propyl N-[(1R)-1-[3-[(4-cyano-3-methoxy-phenyl)carbamoylamino]phenyl]ethyl]carbamate CAS Name: N-[(1R)-1-[3-[[(4-cyano-3-methoxyanilino)-oxomethyl]amino]phenyl]ethyl]carbamic acid 1-cyanobutan-2-yl ester IUPAC Name: 1-cyanobutan-2-yl N-[(1R)-1-[3-[(4-cyano-3-methoxyphenyl)carbamoylamino]phenyl]ethyl]carbamate Traditional Name: N-[(1R)-1-[3-[(4-cyano-3-methoxy-phenyl)carbamoylamino]phenyl]ethyl]carbamic acid 1-(cyanomethyl)propyl ester Formula: C23H25N5O4 MolecularWeight: 435.4757

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC#N)OC(=O)NC(C)C1=CC(=CC=C1)NC(=O)NC2=CC(=C(C=C2)C#N)OC

Isomeric SMILES

CCC(CC#N)OC(=O)N[C@H](C)C1=CC(=CC=C1)NC(=O)NC2=CC(=C(C=C2)C#N)OC

InChI

InChI=1S/C23H25N5O4/c1-4-20(10-11-24)32-23(30)26-15(2)16-6-5-7-18(12-16)27-22(29)28-19-9-8-17(14-25)21(13-19)31-3/h5-9,12-13,15,20H,4,10H2,1-3H3,(H,26,30)(H2,27,28,29)/t15-,20?/m1/s1