3-[[4-[bis(azanyl)methylidene]imidazol-2-yl]methyl]-8-[4-(2,6-dimethylpiperidin-1-yl)pentyl]-1H-quinoxalin-2-one

Systemtic Name: 3-[[4-[bis(azanyl)methylidene]imidazol-2-yl]methyl]-8-[4-(2,6-dimethylpiperidin-1-yl)pentyl]-1H-quinoxalin-2-one Openeye Name: 3-[[4-(diaminomethylene)imidazol-2-yl]methyl]-8-[4-(2,6-dimethyl-1-piperidyl)pentyl]-1H-quinoxalin-2-one CAS Name: 3-[[4-(diaminomethylidene)-2-imidazolyl]methyl]-8-[4-(2,6-dimethyl-1-piperidinyl)pentyl]-1H-quinoxalin-2-one IUPAC Name: 3-[[4-(diaminomethylidene)imidazol-2-yl]methyl]-8-[4-(2,6-dimethylpiperidin-1-yl)pentyl]-1H-quinoxalin-2-one Traditional Name: 3-[[4-(diaminomethylene)imidazol-2-yl]methyl]-8-[4-(2,6-dimethylpiperidino)pentyl]-1H-quinoxalin-2-one Formula: C25H35N7O MolecularWeight: 449.5917

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(N1C(C)CCCC2=C3C(=CC=C2)N=C(C(=O)N3)CC4=NC(=C(N)N)C=N4)C

Isomeric SMILES

CC1CCCC(N1C(C)CCCC2=C3C(=CC=C2)N=C(C(=O)N3)CC4=NC(=C(N)N)C=N4)C

InChI

InChI=1S/C25H35N7O/c1-15-7-4-8-16(2)32(15)17(3)9-5-10-18-11-6-12-19-23(18)31-25(33)20(29-19)13-22-28-14-21(30-22)24(26)27/h6,11-12,14-17H,4-5,7-10,13,26-27H2,1-3H3,(H,31,33)