[2-oxidanylidene-2-[2-(thiophen-2-ylmethylsulfanyl)ethylamino]ethyl] 4-methanoylbenzoate

Systemtic Name: [2-oxidanylidene-2-[2-(thiophen-2-ylmethylsulfanyl)ethylamino]ethyl] 4-methanoylbenzoate Openeye Name: [2-oxo-2-[2-(2-thienylmethylsulfanyl)ethylamino]ethyl] 4-formylbenzoate CAS Name: 4-formylbenzoic acid [2-oxo-2-[2-(thiophen-2-ylmethylthio)ethylamino]ethyl] ester IUPAC Name: [2-oxo-2-[2-(thiophen-2-ylmethylsulfanyl)ethylamino]ethyl] 4-formylbenzoate Traditional Name: 4-formylbenzoic acid [2-keto-2-[2-(2-thenylthio)ethylamino]ethyl] ester Formula: C17H17NO4S2 MolecularWeight: 363.45118

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)CSCCNC(=O)COC(=O)C2=CC=C(C=C2)C=O

Isomeric SMILES

C1=CSC(=C1)CSCCNC(=O)COC(=O)C2=CC=C(C=C2)C=O

InChI

InChI=1S/C17H17NO4S2/c19-10-13-3-5-14(6-4-13)17(21)22-11-16(20)18-7-9-23-12-15-2-1-8-24-15/h1-6,8,10H,7,9,11-12H2,(H,18,20)