N-[2-[[(2S)-2-(4-nitrophenyl)-2-oxidanyl-ethyl]amino]-2-oxidanylidene-ethyl]thiophene-2-carboxamide

Systemtic Name: N-[2-[[(2S)-2-(4-nitrophenyl)-2-oxidanyl-ethyl]amino]-2-oxidanylidene-ethyl]thiophene-2-carboxamide Openeye Name: N-[2-[[(2S)-2-hydroxy-2-(4-nitrophenyl)ethyl]amino]-2-oxo-ethyl]thiophene-2-carboxamide CAS Name: N-[2-[[(2S)-2-hydroxy-2-(4-nitrophenyl)ethyl]amino]-2-oxoethyl]-2-thiophenecarboxamide IUPAC Name: N-[2-[[(2S)-2-hydroxy-2-(4-nitrophenyl)ethyl]amino]-2-oxoethyl]thiophene-2-carboxamide Traditional Name: N-[2-[[(2S)-2-hydroxy-2-(4-nitrophenyl)ethyl]amino]-2-keto-ethyl]thiophene-2-carboxamide Formula: C15H15N3O5S MolecularWeight: 349.3617

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C(=O)NCC(=O)NCC(C2=CC=C(C=C2)[N+](=O)[O-])O

Isomeric SMILES

C1=CSC(=C1)C(=O)NCC(=O)NC[C@H](C2=CC=C(C=C2)[N+](=O)[O-])O

InChI

InChI=1S/C15H15N3O5S/c19-12(10-3-5-11(6-4-10)18(22)23)8-16-14(20)9-17-15(21)13-2-1-7-24-13/h1-7,12,19H,8-9H2,(H,16,20)(H,17,21)/t12-/m1/s1