ethyl 3-(ethylcarbamothioylamino)-4,5,6,7-tetrahydro-2-benzothiophene-1-carboxylate

Systemtic Name: ethyl 3-(ethylcarbamothioylamino)-4,5,6,7-tetrahydro-2-benzothiophene-1-carboxylate Openeye Name: ethyl 3-(ethylcarbamothioylamino)-4,5,6,7-tetrahydro-2-benzothiophene-1-carboxylate CAS Name: 3-[[ethylamino(sulfanylidene)methyl]amino]-4,5,6,7-tetrahydro-2-benzothiophene-1-carboxylic acid ethyl ester IUPAC Name: ethyl 3-(ethylcarbamothioylamino)-4,5,6,7-tetrahydro-2-benzothiophene-1-carboxylate Traditional Name: 3-(ethylthiocarbamoylamino)-4,5,6,7-tetrahydroisobenzothiophene-1-carboxylic acid ethyl ester Formula: C14H20N2O2S2 MolecularWeight: 312.4508

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=S)NC1=C2CCCCC2=C(S1)C(=O)OCC

Isomeric SMILES

CCNC(=S)NC1=C2CCCCC2=C(S1)C(=O)OCC

InChI

InChI=1S/C14H20N2O2S2/c1-3-15-14(19)16-12-10-8-6-5-7-9(10)11(20-12)13(17)18-4-2/h3-8H2,1-2H3,(H2,15,16,19)