2-methoxycarbothioylsulfanyl-4-(4-phenylphenyl)butanoic acid

Systemtic Name: 2-methoxycarbothioylsulfanyl-4-(4-phenylphenyl)butanoic acid Openeye Name: 2-methoxycarbothioylsulfanyl-4-(4-phenylphenyl)butanoic acid CAS Name: 2-[[methoxy(sulfanylidene)methyl]thio]-4-(4-phenylphenyl)butanoic acid IUPAC Name: 2-methoxycarbothioylsulfanyl-4-(4-phenylphenyl)butanoic acid Traditional Name: 2-(methoxycarbothioylthio)-4-(4-phenylphenyl)butyric acid Formula: C18H18O3S2 MolecularWeight: 346.46372

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Descriptors Computed from Structure

Canonical SMILES:

COC(=S)SC(CCC1=CC=C(C=C1)C2=CC=CC=C2)C(=O)O

Isomeric SMILES

COC(=S)SC(CCC1=CC=C(C=C1)C2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C18H18O3S2/c1-21-18(22)23-16(17(19)20)12-9-13-7-10-15(11-8-13)14-5-3-2-4-6-14/h2-8,10-11,16H,9,12H2,1H3,(H,19,20)