N1'-azanyl-3-[3-(2,6-dimethylpiperidin-1-yl)pentyl]-4-oxidanylidene-5-quinolin-3-yl-cyclohexene-1,3-dicarboximidamide

Systemtic Name: N1'-azanyl-3-[3-(2,6-dimethylpiperidin-1-yl)pentyl]-4-oxidanylidene-5-quinolin-3-yl-cyclohexene-1,3-dicarboximidamide Openeye Name: N1'-amino-3-[3-(2,6-dimethyl-1-piperidyl)pentyl]-4-oxo-5-(3-quinolyl)cyclohexene-1,3-dicarboxamidine CAS Name: N1'-amino-3-[3-(2,6-dimethyl-1-piperidinyl)pentyl]-4-oxo-5-(3-quinolinyl)cyclohexene-1,3-dicarboximidamide IUPAC Name: 1-N'-amino-3-[3-(2,6-dimethylpiperidin-1-yl)pentyl]-4-oxo-5-quinolin-3-ylcyclohexene-1,3-dicarboximidamide Traditional Name: N1'-amino-3-[3-(2,6-dimethylpiperidino)pentyl]-4-keto-5-(3-quinolyl)cyclohexene-1,3-dicarboxamidine Formula: C29H41N7O MolecularWeight: 503.68214

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CCC1(C=C(CC(C1=O)C2=CC3=CC=CC=C3N=C2)C(=NN)N)C(=N)N)N4C(CCCC4C)C

Isomeric SMILES

CCC(CCC1(C=C(CC(C1=O)C2=CC3=CC=CC=C3N=C2)/C(=N\N)/N)C(=N)N)N4C(CCCC4C)C

InChI

InChI=1S/C29H41N7O/c1-4-23(36-18(2)8-7-9-19(36)3)12-13-29(28(31)32)16-21(27(30)35-33)15-24(26(29)37)22-14-20-10-5-6-11-25(20)34-17-22/h5-6,10-11,14,16-19,23-24H,4,7-9,12-13,15,33H2,1-3H3,(H2,30,35)(H3,31,32)