8-[4-[4-(5-isocyano-1-methyl-indol-3-yl)cyclohexyl]piperazin-1-yl]-1,6-naphthyridine

Systemtic Name: 8-[4-[4-(5-isocyano-1-methyl-indol-3-yl)cyclohexyl]piperazin-1-yl]-1,6-naphthyridine Openeye Name: 8-[4-[4-(5-isocyano-1-methyl-indol-3-yl)cyclohexyl]piperazin-1-yl]-1,6-naphthyridine CAS Name: 8-[4-[4-(5-isocyano-1-methyl-3-indolyl)cyclohexyl]-1-piperazinyl]-1,6-naphthyridine IUPAC Name: 8-[4-[4-(5-isocyano-1-methylindol-3-yl)cyclohexyl]piperazin-1-yl]-1,6-naphthyridine Traditional Name: 8-[4-[4-(5-isocyano-1-methyl-indol-3-yl)cyclohexyl]piperazino]-1,6-naphthyridine Formula: C28H30N6 MolecularWeight: 450.578

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C2=C1C=CC(=C2)[N+]#[C-])C3CCC(CC3)N4CCN(CC4)C5=C6C(=CN=C5)C=CC=N6

Isomeric SMILES

CN1C=C(C2=C1C=CC(=C2)[N+]#[C-])C3CCC(CC3)N4CCN(CC4)C5=C6C(=CN=C5)C=CC=N6

InChI

InChI=1S/C28H30N6/c1-29-22-7-10-26-24(16-22)25(19-32(26)2)20-5-8-23(9-6-20)33-12-14-34(15-13-33)27-18-30-17-21-4-3-11-31-28(21)27/h3-4,7,10-11,16-20,23H,5-6,8-9,12-15H2,2H3