[4-(1,3-dithiolan-2-yl)phenyl] 4-(thiophen-2-ylcarbonylamino)butanoate

Systemtic Name: [4-(1,3-dithiolan-2-yl)phenyl] 4-(thiophen-2-ylcarbonylamino)butanoate Openeye Name: [4-(1,3-dithiolan-2-yl)phenyl] 4-(thiophene-2-carbonylamino)butanoate CAS Name: 4-[[oxo(thiophen-2-yl)methyl]amino]butanoic acid [4-(1,3-dithiolan-2-yl)phenyl] ester IUPAC Name: [4-(1,3-dithiolan-2-yl)phenyl] 4-(thiophene-2-carbonylamino)butanoate Traditional Name: 4-(2-thenoylamino)butyric acid [4-(1,3-dithiolan-2-yl)phenyl] ester Formula: C18H19NO3S3 MolecularWeight: 393.54336

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC(S1)C2=CC=C(C=C2)OC(=O)CCCNC(=O)C3=CC=CS3

Isomeric SMILES

C1CSC(S1)C2=CC=C(C=C2)OC(=O)CCCNC(=O)C3=CC=CS3

InChI

InChI=1S/C18H19NO3S3/c20-16(4-1-9-19-17(21)15-3-2-10-23-15)22-14-7-5-13(6-8-14)18-24-11-12-25-18/h2-3,5-8,10,18H,1,4,9,11-12H2,(H,19,21)