[4-(5-morpholin-4-ylsulfonylpyridin-1-ium-2-yl)piperazin-1-yl]-thiophen-2-yl-methanone

Systemtic Name: [4-(5-morpholin-4-ylsulfonylpyridin-1-ium-2-yl)piperazin-1-yl]-thiophen-2-yl-methanone Openeye Name: [4-(5-morpholinosulfonylpyridin-1-ium-2-yl)piperazin-1-yl]-(2-thienyl)methanone CAS Name: [4-[5-(4-morpholinylsulfonyl)-2-pyridin-1-iumyl]-1-piperazinyl]-thiophen-2-ylmethanone IUPAC Name: [4-(5-morpholin-4-ylsulfonylpyridin-1-ium-2-yl)piperazin-1-yl]-thiophen-2-ylmethanone Traditional Name: [4-(5-morpholinosulfonylpyridin-1-ium-2-yl)piperazino]-(2-thienyl)methanone Formula: C18H23N4O4S2+ MolecularWeight: 423.52962

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=[NH+]C=C(C=C2)S(=O)(=O)N3CCOCC3)C(=O)C4=CC=CS4

Isomeric SMILES

C1CN(CCN1C2=[NH+]C=C(C=C2)S(=O)(=O)N3CCOCC3)C(=O)C4=CC=CS4

InChI

InChI=1S/C18H22N4O4S2/c23-18(16-2-1-13-27-16)21-7-5-20(6-8-21)17-4-3-15(14-19-17)28(24,25)22-9-11-26-12-10-22/h1-4,13-14H,5-12H2/p+1