N-(cyclopentylcarbamoyl)-3-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]piperazin-1-ium-1-yl]propanamide

Systemtic Name: N-(cyclopentylcarbamoyl)-3-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]piperazin-1-ium-1-yl]propanamide Openeye Name: N-(cyclopentylcarbamoyl)-3-[4-(3,5-dimethylisoxazol-4-yl)sulfonylpiperazin-1-ium-1-yl]propanamide CAS Name: N-[(cyclopentylamino)-oxomethyl]-3-[4-[(3,5-dimethyl-4-isoxazolyl)sulfonyl]-1-piperazin-1-iumyl]propanamide IUPAC Name: N-(cyclopentylcarbamoyl)-3-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]piperazin-1-ium-1-yl]propanamide Traditional Name: N-(cyclopentylcarbamoyl)-3-[4-(3,5-dimethylisoxazol-4-yl)sulfonylpiperazin-1-ium-1-yl]propionamide Formula: C18H30N5O5S+ MolecularWeight: 428.5263

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)S(=O)(=O)N2CC[NH+](CC2)CCC(=O)NC(=O)NC3CCCC3

Isomeric SMILES

CC1=C(C(=NO1)C)S(=O)(=O)N2CC[NH+](CC2)CCC(=O)NC(=O)NC3CCCC3

InChI

InChI=1S/C18H29N5O5S/c1-13-17(14(2)28-21-13)29(26,27)23-11-9-22(10-12-23)8-7-16(24)20-18(25)19-15-5-3-4-6-15/h15H,3-12H2,1-2H3,(H2,19,20,24,25)/p+1