N-(2-diethylaminoethyl)-2-[4-[[4-(2-oxidanylidene-3H-benzimidazol-1-yl)piperidin-1-yl]methyl]phenyl]-3-phenyl-quinoxaline-6-carboxamide

Systemtic Name: N-(2-diethylaminoethyl)-2-[4-[[4-(2-oxidanylidene-3H-benzimidazol-1-yl)piperidin-1-yl]methyl]phenyl]-3-phenyl-quinoxaline-6-carboxamide Openeye Name: N-(2-diethylaminoethyl)-2-[4-[[4-(2-oxo-3H-benzimidazol-1-yl)-1-piperidyl]methyl]phenyl]-3-phenyl-quinoxaline-6-carboxamide CAS Name: N-(2-diethylaminoethyl)-2-[4-[[4-(2-oxo-3H-benzimidazol-1-yl)-1-piperidinyl]methyl]phenyl]-3-phenyl-6-quinoxalinecarboxamide IUPAC Name: N-(2-diethylaminoethyl)-2-[4-[[4-(2-oxo-3H-benzimidazol-1-yl)piperidin-1-yl]methyl]phenyl]-3-phenylquinoxaline-6-carboxamide Traditional Name: N-(2-diethylaminoethyl)-2-[4-[[4-(2-keto-3H-benzimidazol-1-yl)piperidino]methyl]phenyl]-3-phenyl-quinoxaline-6-carboxamide Formula: C40H43N7O2 MolecularWeight: 653.81512

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCNC(=O)C1=CC2=C(C=C1)N=C(C(=N2)C3=CC=CC=C3)C4=CC=C(C=C4)CN5CCC(CC5)N6C7=CC=CC=C7NC6=O

Isomeric SMILES

CCN(CC)CCNC(=O)C1=CC2=C(C=C1)N=C(C(=N2)C3=CC=CC=C3)C4=CC=C(C=C4)CN5CCC(CC5)N6C7=CC=CC=C7NC6=O

InChI

InChI=1S/C40H43N7O2/c1-3-45(4-2)25-22-41-39(48)31-18-19-33-35(26-31)43-37(29-10-6-5-7-11-29)38(42-33)30-16-14-28(15-17-30)27-46-23-20-32(21-24-46)47-36-13-9-8-12-34(36)44-40(47)49/h5-19,26,32H,3-4,20-25,27H2,1-2H3,(H,41,48)(H,44,49)