2-[di(propanoyl)amino]-3-thiophen-2-yl-benzenesulfonic acid

Systemtic Name: 2-[di(propanoyl)amino]-3-thiophen-2-yl-benzenesulfonic acid Openeye Name: 2-[di(propanoyl)amino]-3-(2-thienyl)benzenesulfonic acid CAS Name: 2-[bis(1-oxopropyl)amino]-3-thiophen-2-ylbenzenesulfonic acid IUPAC Name: 2-[di(propanoyl)amino]-3-thiophen-2-ylbenzenesulfonic acid Traditional Name: 2-(dipropionylamino)-3-(2-thienyl)besylic acid Formula: C16H17NO5S2 MolecularWeight: 367.43988

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N(C1=C(C=CC=C1S(=O)(=O)O)C2=CC=CS2)C(=O)CC

Isomeric SMILES

CCC(=O)N(C1=C(C=CC=C1S(=O)(=O)O)C2=CC=CS2)C(=O)CC

InChI

InChI=1S/C16H17NO5S2/c1-3-14(18)17(15(19)4-2)16-11(12-8-6-10-23-12)7-5-9-13(16)24(20,21)22/h5-10H,3-4H2,1-2H3,(H,20,21,22)