2-[[1,2-dihydropyridin-2-ylmethyl(piperidin-2-ylmethyl)amino]methyl]-6-[(2-dimethylaminoethylamino)methylidene]-4-methyl-cyclohexa-2,4-dien-1-one

Systemtic Name: 2-[[1,2-dihydropyridin-2-ylmethyl(piperidin-2-ylmethyl)amino]methyl]-6-[(2-dimethylaminoethylamino)methylidene]-4-methyl-cyclohexa-2,4-dien-1-one Openeye Name: 2-[[1,2-dihydropyridin-2-ylmethyl(2-piperidylmethyl)amino]methyl]-6-[(2-dimethylaminoethylamino)methylene]-4-methyl-cyclohexa-2,4-dien-1-one CAS Name: 2-[[1,2-dihydropyridin-2-ylmethyl(2-piperidinylmethyl)amino]methyl]-6-[(2-dimethylaminoethylamino)methylidene]-4-methyl-1-cyclohexa-2,4-dienone IUPAC Name: 2-[[1,2-dihydropyridin-2-ylmethyl(piperidin-2-ylmethyl)amino]methyl]-6-[(2-dimethylaminoethylamino)methylidene]-4-methylcyclohexa-2,4-dien-1-one Traditional Name: 2-[[1,2-dihydropyridin-2-ylmethyl(2-piperidylmethyl)amino]methyl]-6-[(2-dimethylaminoethylamino)methylene]-4-methyl-cyclohexa-2,4-dien-1-one Formula: C25H39N5O MolecularWeight: 425.61006

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CNCCN(C)C)C(=O)C(=C1)CN(CC2CCCCN2)CC3C=CC=CN3

Isomeric SMILES

CC1=CC(=CNCCN(C)C)C(=O)C(=C1)CN(CC2CCCCN2)CC3C=CC=CN3

InChI

InChI=1S/C25H39N5O/c1-20-14-21(16-26-12-13-29(2)3)25(31)22(15-20)17-30(18-23-8-4-6-10-27-23)19-24-9-5-7-11-28-24/h4,6,8,10,14-16,23-24,26-28H,5,7,9,11-13,17-19H2,1-3H3