N-[4-[4-(1,6-dimethylcyclohexa-2,4-dien-1-yl)piperazin-1-yl]butyl]-4-phenyl-pyridin-2-amine

Systemtic Name: N-[4-[4-(1,6-dimethylcyclohexa-2,4-dien-1-yl)piperazin-1-yl]butyl]-4-phenyl-pyridin-2-amine Openeye Name: N-[4-[4-(1,6-dimethylcyclohexa-2,4-dien-1-yl)piperazin-1-yl]butyl]-4-phenyl-pyridin-2-amine CAS Name: N-[4-[4-(1,6-dimethyl-1-cyclohexa-2,4-dienyl)-1-piperazinyl]butyl]-4-phenyl-2-pyridinamine IUPAC Name: N-[4-[4-(1,6-dimethylcyclohexa-2,4-dien-1-yl)piperazin-1-yl]butyl]-4-phenylpyridin-2-amine Traditional Name: 4-[4-(1,6-dimethylcyclohexa-2,4-dien-1-yl)piperazino]butyl-(4-phenyl-2-pyridyl)amine Formula: C27H36N4 MolecularWeight: 416.60154

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Descriptors Computed from Structure

Canonical SMILES:

CC1C=CC=CC1(C)N2CCN(CC2)CCCCNC3=NC=CC(=C3)C4=CC=CC=C4

Isomeric SMILES

CC1C=CC=CC1(C)N2CCN(CC2)CCCCNC3=NC=CC(=C3)C4=CC=CC=C4

InChI

InChI=1S/C27H36N4/c1-23-10-6-7-14-27(23,2)31-20-18-30(19-21-31)17-9-8-15-28-26-22-25(13-16-29-26)24-11-4-3-5-12-24/h3-7,10-14,16,22-23H,8-9,15,17-21H2,1-2H3,(H,28,29)