4-[4-[[2,3-bis(chloranyl)phenyl]carbamoylamino]phenyl]-N-butyl-piperazine-1-carboxamide

Systemtic Name: 4-[4-[[2,3-bis(chloranyl)phenyl]carbamoylamino]phenyl]-N-butyl-piperazine-1-carboxamide Openeye Name: N-butyl-4-[4-[(2,3-dichlorophenyl)carbamoylamino]phenyl]piperazine-1-carboxamide CAS Name: N-butyl-4-[4-[[(2,3-dichloroanilino)-oxomethyl]amino]phenyl]-1-piperazinecarboxamide IUPAC Name: N-butyl-4-[4-[(2,3-dichlorophenyl)carbamoylamino]phenyl]piperazine-1-carboxamide Traditional Name: N-butyl-4-[4-[(2,3-dichlorophenyl)carbamoylamino]phenyl]piperazine-1-carboxamide Formula: C22H27Cl2N5O2 MolecularWeight: 464.38808

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)N1CCN(CC1)C2=CC=C(C=C2)NC(=O)NC3=C(C(=CC=C3)Cl)Cl

Isomeric SMILES

CCCCNC(=O)N1CCN(CC1)C2=CC=C(C=C2)NC(=O)NC3=C(C(=CC=C3)Cl)Cl

InChI

InChI=1S/C22H27Cl2N5O2/c1-2-3-11-25-22(31)29-14-12-28(13-15-29)17-9-7-16(8-10-17)26-21(30)27-19-6-4-5-18(23)20(19)24/h4-10H,2-3,11-15H2,1H3,(H,25,31)(H2,26,27,30)