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

Systemtic Name: [4-(naphthalen-1-ylmethyl)piperazin-4-ium-1-yl]-(2-thiophen-3-yl-1,3-thiazol-4-yl)methanone Openeye Name: [4-(1-naphthylmethyl)piperazin-4-ium-1-yl]-[2-(3-thienyl)thiazol-4-yl]methanone CAS Name: [4-(1-naphthalenylmethyl)-1-piperazin-4-iumyl]-[2-(3-thiophenyl)-4-thiazolyl]methanone IUPAC Name: [4-(naphthalen-1-ylmethyl)piperazin-4-ium-1-yl]-(2-thiophen-3-yl-1,3-thiazol-4-yl)methanone Traditional Name: [4-(1-naphthylmethyl)piperazin-4-ium-1-yl]-[2-(3-thienyl)thiazol-4-yl]methanone Formula: C23H22N3OS2+ MolecularWeight: 420.57028

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H21N3OS2/c27-23(21-16-29-22(24-21)19-8-13-28-15-19)26-11-9-25(10-12-26)14-18-6-3-5-17-4-1-2-7-20(17)18/h1-8,13,15-16H,9-12,14H2/p+1