N-[3-[[6-(4-methylpiperazin-4-ium-1-yl)pyridin-3-yl]amino]-3-oxidanylidene-propyl]thiophene-3-carboxamide

Systemtic Name: N-[3-[[6-(4-methylpiperazin-4-ium-1-yl)pyridin-3-yl]amino]-3-oxidanylidene-propyl]thiophene-3-carboxamide Openeye Name: N-[3-[[6-(4-methylpiperazin-4-ium-1-yl)-3-pyridyl]amino]-3-oxo-propyl]thiophene-3-carboxamide CAS Name: N-[3-[[6-(4-methyl-1-piperazin-4-iumyl)-3-pyridinyl]amino]-3-oxopropyl]-3-thiophenecarboxamide IUPAC Name: N-[3-[[6-(4-methylpiperazin-4-ium-1-yl)pyridin-3-yl]amino]-3-oxopropyl]thiophene-3-carboxamide Traditional Name: N-[3-keto-3-[[6-(4-methylpiperazin-4-ium-1-yl)-3-pyridyl]amino]propyl]thiophene-3-carboxamide Formula: C18H24N5O2S+ MolecularWeight: 374.48046

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=NC=C(C=C2)NC(=O)CCNC(=O)C3=CSC=C3

Isomeric SMILES

C[NH+]1CCN(CC1)C2=NC=C(C=C2)NC(=O)CCNC(=O)C3=CSC=C3

InChI

InChI=1S/C18H23N5O2S/c1-22-7-9-23(10-8-22)16-3-2-15(12-20-16)21-17(24)4-6-19-18(25)14-5-11-26-13-14/h2-3,5,11-13H,4,6-10H2,1H3,(H,19,25)(H,21,24)/p+1