2-(4-ethylpiperazin-1-yl)-N-(phenylmethyl)quinazolin-3-ium-4-amine

Systemtic Name: 2-(4-ethylpiperazin-1-yl)-N-(phenylmethyl)quinazolin-3-ium-4-amine Openeye Name: N-benzyl-2-(4-ethylpiperazin-1-yl)quinazolin-3-ium-4-amine CAS Name: 2-(4-ethyl-1-piperazinyl)-N-(phenylmethyl)-4-quinazolin-3-iumamine IUPAC Name: N-benzyl-2-(4-ethylpiperazin-1-yl)quinazolin-3-ium-4-amine Traditional Name: benzyl-[2-(4-ethylpiperazino)quinazolin-3-ium-4-yl]amine Formula: C21H26N5+ MolecularWeight: 348.46464

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=NC3=CC=CC=C3C(=[NH+]2)NCC4=CC=CC=C4

Isomeric SMILES

CCN1CCN(CC1)C2=NC3=CC=CC=C3C(=[NH+]2)NCC4=CC=CC=C4

InChI

InChI=1S/C21H25N5/c1-2-25-12-14-26(15-13-25)21-23-19-11-7-6-10-18(19)20(24-21)22-16-17-8-4-3-5-9-17/h3-11H,2,12-16H2,1H3,(H,22,23,24)/p+1