8-[4-[4-(5-isocyano-1-methyl-indol-3-yl)cyclohexyl]piperazin-1-yl]-N-methyl-quinolin-6-amine

Systemtic Name: 8-[4-[4-(5-isocyano-1-methyl-indol-3-yl)cyclohexyl]piperazin-1-yl]-N-methyl-quinolin-6-amine Openeye Name: 8-[4-[4-(5-isocyano-1-methyl-indol-3-yl)cyclohexyl]piperazin-1-yl]-N-methyl-quinolin-6-amine CAS Name: 8-[4-[4-(5-isocyano-1-methyl-3-indolyl)cyclohexyl]-1-piperazinyl]-N-methyl-6-quinolinamine IUPAC Name: 8-[4-[4-(5-isocyano-1-methylindol-3-yl)cyclohexyl]piperazin-1-yl]-N-methylquinolin-6-amine Traditional Name: [8-[4-[4-(5-isocyano-1-methyl-indol-3-yl)cyclohexyl]piperazino]-6-quinolyl]-methyl-amine Formula: C30H34N6 MolecularWeight: 478.63116

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=CC(=C2C(=C1)C=CC=N2)N3CCN(CC3)C4CCC(CC4)C5=CN(C6=C5C=C(C=C6)[N+]#[C-])C

Isomeric SMILES

CNC1=CC(=C2C(=C1)C=CC=N2)N3CCN(CC3)C4CCC(CC4)C5=CN(C6=C5C=C(C=C6)[N+]#[C-])C

InChI

InChI=1S/C30H34N6/c1-31-23-8-11-28-26(18-23)27(20-34(28)3)21-6-9-25(10-7-21)35-13-15-36(16-14-35)29-19-24(32-2)17-22-5-4-12-33-30(22)29/h4-5,8,11-12,17-21,25,32H,6-7,9-10,13-16H2,2-3H3