2-[[cyclohexyl(methyl)carbamothioyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid

Systemtic Name: 2-[[cyclohexyl(methyl)carbamothioyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid Openeye Name: 2-[[cyclohexyl(methyl)carbamothioyl]amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid CAS Name: 2-[[[cyclohexyl(methyl)amino]-sulfanylidenemethyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid IUPAC Name: 2-[[cyclohexyl(methyl)carbamothioyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid Traditional Name: 2-[[cyclohexyl(methyl)thiocarbamoyl]amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid Formula: C17H24N2O2S2 MolecularWeight: 352.51466

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCCCC1)C(=S)NC2=C(C3=C(S2)CCCC3)C(=O)O

Isomeric SMILES

CN(C1CCCCC1)C(=S)NC2=C(C3=C(S2)CCCC3)C(=O)O

InChI

InChI=1S/C17H24N2O2S2/c1-19(11-7-3-2-4-8-11)17(22)18-15-14(16(20)21)12-9-5-6-10-13(12)23-15/h11H,2-10H2,1H3,(H,18,22)(H,20,21)