5-(cyclopropylcarbonylamino)-3-methyl-N-[6-(4-methylpiperazin-4-ium-1-yl)pyridin-3-yl]thiophene-2-carboxamide

Systemtic Name: 5-(cyclopropylcarbonylamino)-3-methyl-N-[6-(4-methylpiperazin-4-ium-1-yl)pyridin-3-yl]thiophene-2-carboxamide Openeye Name: 5-(cyclopropanecarbonylamino)-3-methyl-N-[6-(4-methylpiperazin-4-ium-1-yl)-3-pyridyl]thiophene-2-carboxamide CAS Name: 5-[[cyclopropyl(oxo)methyl]amino]-3-methyl-N-[6-(4-methyl-1-piperazin-4-iumyl)-3-pyridinyl]-2-thiophenecarboxamide IUPAC Name: 5-(cyclopropanecarbonylamino)-3-methyl-N-[6-(4-methylpiperazin-4-ium-1-yl)pyridin-3-yl]thiophene-2-carboxamide Traditional Name: 5-(cyclopropanecarbonylamino)-3-methyl-N-[6-(4-methylpiperazin-4-ium-1-yl)-3-pyridyl]thiophene-2-carboxamide Formula: C20H26N5O2S+ MolecularWeight: 400.51774

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1)NC(=O)C2CC2)C(=O)NC3=CN=C(C=C3)N4CC[NH+](CC4)C

Isomeric SMILES

CC1=C(SC(=C1)NC(=O)C2CC2)C(=O)NC3=CN=C(C=C3)N4CC[NH+](CC4)C

InChI

InChI=1S/C20H25N5O2S/c1-13-11-17(23-19(26)14-3-4-14)28-18(13)20(27)22-15-5-6-16(21-12-15)25-9-7-24(2)8-10-25/h5-6,11-12,14H,3-4,7-10H2,1-2H3,(H,22,27)(H,23,26)/p+1