[4-(naphthalen-1-ylmethyl)piperazin-4-ium-1-yl]-(5-thiophen-2-yl-1,3-oxazol-4-yl)methanone

Systemtic Name: [4-(naphthalen-1-ylmethyl)piperazin-4-ium-1-yl]-(5-thiophen-2-yl-1,3-oxazol-4-yl)methanone Openeye Name: [4-(1-naphthylmethyl)piperazin-4-ium-1-yl]-[5-(2-thienyl)oxazol-4-yl]methanone CAS Name: [4-(1-naphthalenylmethyl)-1-piperazin-4-iumyl]-(5-thiophen-2-yl-4-oxazolyl)methanone IUPAC Name: [4-(naphthalen-1-ylmethyl)piperazin-4-ium-1-yl]-(5-thiophen-2-yl-1,3-oxazol-4-yl)methanone Traditional Name: [4-(1-naphthylmethyl)piperazin-4-ium-1-yl]-[5-(2-thienyl)oxazol-4-yl]methanone Formula: C23H22N3O2S+ MolecularWeight: 404.50468

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=CC3=CC=CC=C32)C(=O)C4=C(OC=N4)C5=CC=CS5

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=CC3=CC=CC=C32)C(=O)C4=C(OC=N4)C5=CC=CS5

InChI

InChI=1S/C23H21N3O2S/c27-23(21-22(28-16-24-21)20-9-4-14-29-20)26-12-10-25(11-13-26)15-18-7-3-6-17-5-1-2-8-19(17)18/h1-9,14,16H,10-13,15H2/p+1