methyl 2-[4-(thiophen-2-ylmethylcarbamothioylamino)phenyl]ethanoate

Systemtic Name: methyl 2-[4-(thiophen-2-ylmethylcarbamothioylamino)phenyl]ethanoate Openeye Name: methyl 2-[4-(2-thienylmethylcarbamothioylamino)phenyl]acetate CAS Name: 2-[4-[[sulfanylidene-(thiophen-2-ylmethylamino)methyl]amino]phenyl]acetic acid methyl ester IUPAC Name: methyl 2-[4-(thiophen-2-ylmethylcarbamothioylamino)phenyl]acetate Traditional Name: 2-[4-(2-thenylthiocarbamoylamino)phenyl]acetic acid methyl ester Formula: C15H16N2O2S2 MolecularWeight: 320.42974

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1=CC=C(C=C1)NC(=S)NCC2=CC=CS2

Isomeric SMILES

COC(=O)CC1=CC=C(C=C1)NC(=S)NCC2=CC=CS2

InChI

InChI=1S/C15H16N2O2S2/c1-19-14(18)9-11-4-6-12(7-5-11)17-15(20)16-10-13-3-2-8-21-13/h2-8H,9-10H2,1H3,(H2,16,17,20)