[2-(dimethylamino)-6-thiophen-3-yl-pyridin-3-yl]-[4-(4-ethylpiperazin-4-ium-1-yl)piperidin-1-yl]methanone

Systemtic Name: [2-(dimethylamino)-6-thiophen-3-yl-pyridin-3-yl]-[4-(4-ethylpiperazin-4-ium-1-yl)piperidin-1-yl]methanone Openeye Name: [2-(dimethylamino)-6-(3-thienyl)-3-pyridyl]-[4-(4-ethylpiperazin-4-ium-1-yl)-1-piperidyl]methanone CAS Name: [2-(dimethylamino)-6-(3-thiophenyl)-3-pyridinyl]-[4-(4-ethyl-1-piperazin-4-iumyl)-1-piperidinyl]methanone IUPAC Name: [2-(dimethylamino)-6-thiophen-3-ylpyridin-3-yl]-[4-(4-ethylpiperazin-4-ium-1-yl)piperidin-1-yl]methanone Traditional Name: [2-(dimethylamino)-6-(3-thienyl)-3-pyridyl]-[4-(4-ethylpiperazin-4-ium-1-yl)piperidino]methanone Formula: C23H34N5OS+ MolecularWeight: 428.61396

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2CCN(CC2)C(=O)C3=C(N=C(C=C3)C4=CSC=C4)N(C)C

Isomeric SMILES

CC[NH+]1CCN(CC1)C2CCN(CC2)C(=O)C3=C(N=C(C=C3)C4=CSC=C4)N(C)C

InChI

InChI=1S/C23H33N5OS/c1-4-26-12-14-27(15-13-26)19-7-10-28(11-8-19)23(29)20-5-6-21(18-9-16-30-17-18)24-22(20)25(2)3/h5-6,9,16-17,19H,4,7-8,10-15H2,1-3H3/p+1