(1-naphthalen-2-ylsulfonylpiperidin-4-yl)-[4-(thiophen-2-ylmethyl)piperazin-4-ium-1-yl]methanone

Systemtic Name: (1-naphthalen-2-ylsulfonylpiperidin-4-yl)-[4-(thiophen-2-ylmethyl)piperazin-4-ium-1-yl]methanone Openeye Name: [1-(2-naphthylsulfonyl)-4-piperidyl]-[4-(2-thienylmethyl)piperazin-4-ium-1-yl]methanone CAS Name: [1-(2-naphthalenylsulfonyl)-4-piperidinyl]-[4-(thiophen-2-ylmethyl)-1-piperazin-4-iumyl]methanone IUPAC Name: (1-naphthalen-2-ylsulfonylpiperidin-4-yl)-[4-(thiophen-2-ylmethyl)piperazin-4-ium-1-yl]methanone Traditional Name: [1-(2-naphthylsulfonyl)-4-piperidyl]-[4-(2-thenyl)piperazin-4-ium-1-yl]methanone Formula: C25H30N3O3S2+ MolecularWeight: 484.654

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)N2CC[NH+](CC2)CC3=CC=CS3)S(=O)(=O)C4=CC5=CC=CC=C5C=C4

Isomeric SMILES

C1CN(CCC1C(=O)N2CC[NH+](CC2)CC3=CC=CS3)S(=O)(=O)C4=CC5=CC=CC=C5C=C4

InChI

InChI=1S/C25H29N3O3S2/c29-25(27-15-13-26(14-16-27)19-23-6-3-17-32-23)21-9-11-28(12-10-21)33(30,31)24-8-7-20-4-1-2-5-22(20)18-24/h1-8,17-18,21H,9-16,19H2/p+1