2-(4-ethylphenyl)-N-[(2R)-2-(4-nitrophenyl)-2-oxidanyl-ethyl]-1,3-thiazole-4-carboxamide

Systemtic Name: 2-(4-ethylphenyl)-N-[(2R)-2-(4-nitrophenyl)-2-oxidanyl-ethyl]-1,3-thiazole-4-carboxamide Openeye Name: 2-(4-ethylphenyl)-N-[(2R)-2-hydroxy-2-(4-nitrophenyl)ethyl]thiazole-4-carboxamide CAS Name: 2-(4-ethylphenyl)-N-[(2R)-2-hydroxy-2-(4-nitrophenyl)ethyl]-4-thiazolecarboxamide IUPAC Name: 2-(4-ethylphenyl)-N-[(2R)-2-hydroxy-2-(4-nitrophenyl)ethyl]-1,3-thiazole-4-carboxamide Traditional Name: 2-(4-ethylphenyl)-N-[(2R)-2-hydroxy-2-(4-nitrophenyl)ethyl]thiazole-4-carboxamide Formula: C20H19N3O4S MolecularWeight: 397.44756

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=NC(=CS2)C(=O)NCC(C3=CC=C(C=C3)[N+](=O)[O-])O

Isomeric SMILES

CCC1=CC=C(C=C1)C2=NC(=CS2)C(=O)NC[C@@H](C3=CC=C(C=C3)[N+](=O)[O-])O

InChI

InChI=1S/C20H19N3O4S/c1-2-13-3-5-15(6-4-13)20-22-17(12-28-20)19(25)21-11-18(24)14-7-9-16(10-8-14)23(26)27/h3-10,12,18,24H,2,11H2,1H3,(H,21,25)/t18-/m0/s1