4-[2-[methyl(thiophen-2-ylmethyl)amino]-2-oxidanylidene-ethyl]sulfanylbenzoic acid

Systemtic Name: 4-[2-[methyl(thiophen-2-ylmethyl)amino]-2-oxidanylidene-ethyl]sulfanylbenzoic acid Openeye Name: 4-[2-[methyl(2-thienylmethyl)amino]-2-oxo-ethyl]sulfanylbenzoic acid CAS Name: 4-[[2-[methyl(thiophen-2-ylmethyl)amino]-2-oxoethyl]thio]benzoic acid IUPAC Name: 4-[2-[methyl(thiophen-2-ylmethyl)amino]-2-oxoethyl]sulfanylbenzoic acid Traditional Name: 4-[[2-keto-2-[methyl(2-thenyl)amino]ethyl]thio]benzoic acid Formula: C15H15NO3S2 MolecularWeight: 321.4145

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CS1)C(=O)CSC2=CC=C(C=C2)C(=O)O

Isomeric SMILES

CN(CC1=CC=CS1)C(=O)CSC2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C15H15NO3S2/c1-16(9-13-3-2-8-20-13)14(17)10-21-12-6-4-11(5-7-12)15(18)19/h2-8H,9-10H2,1H3,(H,18,19)