N-[(2R)-2-(4-methylpiperazin-4-ium-1-yl)propyl]-5-thiophen-2-yl-1,2-oxazole-3-carboxamide

Systemtic Name: N-[(2R)-2-(4-methylpiperazin-4-ium-1-yl)propyl]-5-thiophen-2-yl-1,2-oxazole-3-carboxamide Openeye Name: N-[(2R)-2-(4-methylpiperazin-4-ium-1-yl)propyl]-5-(2-thienyl)isoxazole-3-carboxamide CAS Name: N-[(2R)-2-(4-methyl-1-piperazin-4-iumyl)propyl]-5-thiophen-2-yl-3-isoxazolecarboxamide IUPAC Name: N-[(2R)-2-(4-methylpiperazin-4-ium-1-yl)propyl]-5-thiophen-2-yl-1,2-oxazole-3-carboxamide Traditional Name: N-[(2R)-2-(4-methylpiperazin-4-ium-1-yl)propyl]-5-(2-thienyl)isoxazole-3-carboxamide Formula: C16H23N4O2S+ MolecularWeight: 335.44442

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNC(=O)C1=NOC(=C1)C2=CC=CS2)N3CC[NH+](CC3)C

Isomeric SMILES

C[C@H](CNC(=O)C1=NOC(=C1)C2=CC=CS2)N3CC[NH+](CC3)C

InChI

InChI=1S/C16H22N4O2S/c1-12(20-7-5-19(2)6-8-20)11-17-16(21)13-10-14(22-18-13)15-4-3-9-23-15/h3-4,9-10,12H,5-8,11H2,1-2H3,(H,17,21)/p+1/t12-/m1/s1