(6S)-6-tert-butyl-2-(cyclohexylcarbonylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Systemtic Name: (6S)-6-tert-butyl-2-(cyclohexylcarbonylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Openeye Name: (6S)-6-tert-butyl-2-(cyclohexanecarbonylamino)-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate CAS Name: (6S)-6-tert-butyl-2-[[cyclohexyl(oxo)methyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate IUPAC Name: (6S)-6-tert-butyl-2-(cyclohexanecarbonylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Traditional Name: (6S)-6-tert-butyl-2-(cyclohexanecarbonylamino)-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate Formula: C20H28NO3S- MolecularWeight: 362.50622

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CCC2=C(C1)SC(=C2C(=O)[O-])NC(=O)C3CCCCC3

Isomeric SMILES

CC(C)(C)[C@H]1CCC2=C(C1)SC(=C2C(=O)[O-])NC(=O)C3CCCCC3

InChI

InChI=1S/C20H29NO3S/c1-20(2,3)13-9-10-14-15(11-13)25-18(16(14)19(23)24)21-17(22)12-7-5-4-6-8-12/h12-13H,4-11H2,1-3H3,(H,21,22)(H,23,24)/p-1/t13-/m0/s1