methyl 2-[[(2S)-2-ethylpiperidin-1-yl]carbothioylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Systemtic Name: methyl 2-[[(2S)-2-ethylpiperidin-1-yl]carbothioylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Openeye Name: methyl 2-[[(2S)-2-ethylpiperidine-1-carbothioyl]amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate CAS Name: 2-[[[(2S)-2-ethyl-1-piperidinyl]-sulfanylidenemethyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid methyl ester IUPAC Name: methyl 2-[[(2S)-2-ethylpiperidine-1-carbothioyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Traditional Name: 2-[[(2S)-2-ethylpiperidine-1-carbothioyl]amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid methyl ester Formula: C18H26N2O2S2 MolecularWeight: 366.54124

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCCN1C(=S)NC2=C(C3=C(S2)CCCC3)C(=O)OC

Isomeric SMILES

CC[C@H]1CCCCN1C(=S)NC2=C(C3=C(S2)CCCC3)C(=O)OC

InChI

InChI=1S/C18H26N2O2S2/c1-3-12-8-6-7-11-20(12)18(23)19-16-15(17(21)22-2)13-9-4-5-10-14(13)24-16/h12H,3-11H2,1-2H3,(H,19,23)/t12-/m0/s1