4-[4-[(3-cyanophenyl)carbamoylamino]phenyl]-N-ethyl-piperazine-1-carboxamide

Systemtic Name: 4-[4-[(3-cyanophenyl)carbamoylamino]phenyl]-N-ethyl-piperazine-1-carboxamide Openeye Name: 4-[4-[(3-cyanophenyl)carbamoylamino]phenyl]-N-ethyl-piperazine-1-carboxamide CAS Name: 4-[4-[[(3-cyanoanilino)-oxomethyl]amino]phenyl]-N-ethyl-1-piperazinecarboxamide IUPAC Name: 4-[4-[(3-cyanophenyl)carbamoylamino]phenyl]-N-ethylpiperazine-1-carboxamide Traditional Name: 4-[4-[(3-cyanophenyl)carbamoylamino]phenyl]-N-ethyl-piperazine-1-carboxamide Formula: C21H24N6O2 MolecularWeight: 392.45426

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)N1CCN(CC1)C2=CC=C(C=C2)NC(=O)NC3=CC=CC(=C3)C#N

Isomeric SMILES

CCNC(=O)N1CCN(CC1)C2=CC=C(C=C2)NC(=O)NC3=CC=CC(=C3)C#N

InChI

InChI=1S/C21H24N6O2/c1-2-23-21(29)27-12-10-26(11-13-27)19-8-6-17(7-9-19)24-20(28)25-18-5-3-4-16(14-18)15-22/h3-9,14H,2,10-13H2,1H3,(H,23,29)(H2,24,25,28)