4-[4-[[5-aminocarbonyl-4-[(phenylmethyl)amino]pyridin-2-yl]amino]phenyl]-N,N-diethyl-piperazine-1-carboxamide

Systemtic Name: 4-[4-[[5-aminocarbonyl-4-[(phenylmethyl)amino]pyridin-2-yl]amino]phenyl]-N,N-diethyl-piperazine-1-carboxamide Openeye Name: 4-[4-[[4-(benzylamino)-5-carbamoyl-2-pyridyl]amino]phenyl]-N,N-diethyl-piperazine-1-carboxamide CAS Name: 4-[4-[[5-carbamoyl-4-[(phenylmethyl)amino]-2-pyridinyl]amino]phenyl]-N,N-diethyl-1-piperazinecarboxamide IUPAC Name: 4-[4-[[4-(benzylamino)-5-carbamoylpyridin-2-yl]amino]phenyl]-N,N-diethylpiperazine-1-carboxamide Traditional Name: 4-[4-[[4-(benzylamino)-5-carbamoyl-2-pyridyl]amino]phenyl]-N,N-diethyl-piperazine-1-carboxamide Formula: C28H35N7O2 MolecularWeight: 501.6232

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)N1CCN(CC1)C2=CC=C(C=C2)NC3=NC=C(C(=C3)NCC4=CC=CC=C4)C(=O)N

Isomeric SMILES

CCN(CC)C(=O)N1CCN(CC1)C2=CC=C(C=C2)NC3=NC=C(C(=C3)NCC4=CC=CC=C4)C(=O)N

InChI

InChI=1S/C28H35N7O2/c1-3-33(4-2)28(37)35-16-14-34(15-17-35)23-12-10-22(11-13-23)32-26-18-25(24(20-31-26)27(29)36)30-19-21-8-6-5-7-9-21/h5-13,18,20H,3-4,14-17,19H2,1-2H3,(H2,29,36)(H2,30,31,32)