3-azanyl-3-[(2-ethylphenyl)carbonylamino]-2-oxidanyl-N-(4-phenylbutanoyl)-1,3-thiazolidin-3-ium-4-carboxamide

Systemtic Name: 3-azanyl-3-[(2-ethylphenyl)carbonylamino]-2-oxidanyl-N-(4-phenylbutanoyl)-1,3-thiazolidin-3-ium-4-carboxamide Openeye Name: 3-amino-3-[(2-ethylbenzoyl)amino]-2-hydroxy-N-(4-phenylbutanoyl)thiazolidin-3-ium-4-carboxamide CAS Name: 3-amino-3-[[(2-ethylphenyl)-oxomethyl]amino]-2-hydroxy-N-(1-oxo-4-phenylbutyl)-4-thiazolidin-3-iumcarboxamide IUPAC Name: 3-amino-3-[(2-ethylbenzoyl)amino]-2-hydroxy-N-(4-phenylbutanoyl)-1,3-thiazolidin-3-ium-4-carboxamide Traditional Name: 3-amino-3-[(2-ethylbenzoyl)amino]-2-hydroxy-N-(4-phenylbutanoyl)thiazolidin-3-ium-4-carboxamide Formula: C23H29N4O4S+ MolecularWeight: 457.56576

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1C(=O)N[N+]2(C(CSC2O)C(=O)NC(=O)CCCC3=CC=CC=C3)N

Isomeric SMILES

CCC1=CC=CC=C1C(=O)N[N+]2(C(CSC2O)C(=O)NC(=O)CCCC3=CC=CC=C3)N

InChI

InChI=1S/C23H28N4O4S/c1-2-17-12-6-7-13-18(17)21(29)26-27(24)19(15-32-23(27)31)22(30)25-20(28)14-8-11-16-9-4-3-5-10-16/h3-7,9-10,12-13,19,23,31H,2,8,11,14-15,24H2,1H3,(H-,25,26,28,29,30)/p+1