4-[2-[methyl(thiophen-3-ylmethyl)amino]-2-oxidanylidene-ethyl]sulfanylbenzoic acid

Systemtic Name: 4-[2-[methyl(thiophen-3-ylmethyl)amino]-2-oxidanylidene-ethyl]sulfanylbenzoic acid Openeye Name: 4-[2-[methyl(3-thienylmethyl)amino]-2-oxo-ethyl]sulfanylbenzoic acid CAS Name: 4-[[2-[methyl(3-thiophenylmethyl)amino]-2-oxoethyl]thio]benzoic acid IUPAC Name: 4-[2-[methyl(thiophen-3-ylmethyl)amino]-2-oxoethyl]sulfanylbenzoic acid Traditional Name: 4-[[2-keto-2-[methyl(3-thenyl)amino]ethyl]thio]benzoic acid Formula: C15H15NO3S2 MolecularWeight: 321.4145

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CSC=C1)C(=O)CSC2=CC=C(C=C2)C(=O)O

Isomeric SMILES

CN(CC1=CSC=C1)C(=O)CSC2=CC=C(C=C2)C(=O)O

InChI

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