N-[1-(phenylmethyl)piperidin-1-ium-4-yl]-2-thiophen-2-yl-quinazolin-4-amine

Systemtic Name: N-[1-(phenylmethyl)piperidin-1-ium-4-yl]-2-thiophen-2-yl-quinazolin-4-amine Openeye Name: N-(1-benzylpiperidin-1-ium-4-yl)-2-(2-thienyl)quinazolin-4-amine CAS Name: N-[1-(phenylmethyl)-4-piperidin-1-iumyl]-2-thiophen-2-yl-4-quinazolinamine IUPAC Name: N-(1-benzylpiperidin-1-ium-4-yl)-2-thiophen-2-ylquinazolin-4-amine Traditional Name: (1-benzylpiperidin-1-ium-4-yl)-[2-(2-thienyl)quinazolin-4-yl]amine Formula: C24H25N4S+ MolecularWeight: 401.5471

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1NC2=NC(=NC3=CC=CC=C32)C4=CC=CS4)CC5=CC=CC=C5

Isomeric SMILES

C1C[NH+](CCC1NC2=NC(=NC3=CC=CC=C32)C4=CC=CS4)CC5=CC=CC=C5

InChI

InChI=1S/C24H24N4S/c1-2-7-18(8-3-1)17-28-14-12-19(13-15-28)25-23-20-9-4-5-10-21(20)26-24(27-23)22-11-6-16-29-22/h1-11,16,19H,12-15,17H2,(H,25,26,27)/p+1