4-[4-(phenylmethyl)piperazin-4-ium-1-yl]-2-thiophen-2-yl-quinazoline

Systemtic Name: 4-[4-(phenylmethyl)piperazin-4-ium-1-yl]-2-thiophen-2-yl-quinazoline Openeye Name: 4-(4-benzylpiperazin-4-ium-1-yl)-2-(2-thienyl)quinazoline CAS Name: 4-[4-(phenylmethyl)-1-piperazin-4-iumyl]-2-thiophen-2-ylquinazoline IUPAC Name: 4-(4-benzylpiperazin-4-ium-1-yl)-2-thiophen-2-ylquinazoline Traditional Name: 4-(4-benzylpiperazin-4-ium-1-yl)-2-(2-thienyl)quinazoline Formula: C23H23N4S+ MolecularWeight: 387.52052

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=CC=C2)C3=NC(=NC4=CC=CC=C43)C5=CC=CS5

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=CC=C2)C3=NC(=NC4=CC=CC=C43)C5=CC=CS5

InChI

InChI=1S/C23H22N4S/c1-2-7-18(8-3-1)17-26-12-14-27(15-13-26)23-19-9-4-5-10-20(19)24-22(25-23)21-11-6-16-28-21/h1-11,16H,12-15,17H2/p+1