6-chloranyl-N-(2-methoxyethyl)-2-[[(2S)-2-methyl-4-phenyl-piperazin-1-ium-1-yl]methyl]quinazolin-4-amine

Systemtic Name: 6-chloranyl-N-(2-methoxyethyl)-2-[[(2S)-2-methyl-4-phenyl-piperazin-1-ium-1-yl]methyl]quinazolin-4-amine Openeye Name: 6-chloro-N-(2-methoxyethyl)-2-[[(2S)-2-methyl-4-phenyl-piperazin-1-ium-1-yl]methyl]quinazolin-4-amine CAS Name: 6-chloro-N-(2-methoxyethyl)-2-[[(2S)-2-methyl-4-phenyl-1-piperazin-1-iumyl]methyl]-4-quinazolinamine IUPAC Name: 6-chloro-N-(2-methoxyethyl)-2-[[(2S)-2-methyl-4-phenylpiperazin-1-ium-1-yl]methyl]quinazolin-4-amine Traditional Name: [6-chloro-2-[[(2S)-2-methyl-4-phenyl-piperazin-1-ium-1-yl]methyl]quinazolin-4-yl]-(2-methoxyethyl)amine Formula: C23H29ClN5O+ MolecularWeight: 426.96226

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC[NH+]1CC2=NC3=C(C=C(C=C3)Cl)C(=N2)NCCOC)C4=CC=CC=C4

Isomeric SMILES

C[C@H]1CN(CC[NH+]1CC2=NC3=C(C=C(C=C3)Cl)C(=N2)NCCOC)C4=CC=CC=C4

InChI

InChI=1S/C23H28ClN5O/c1-17-15-29(19-6-4-3-5-7-19)12-11-28(17)16-22-26-21-9-8-18(24)14-20(21)23(27-22)25-10-13-30-2/h3-9,14,17H,10-13,15-16H2,1-2H3,(H,25,26,27)/p+1/t17-/m0/s1