ethyl (6S)-2-[(1-ethylpyrazol-4-yl)sulfonylamino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Systemtic Name: ethyl (6S)-2-[(1-ethylpyrazol-4-yl)sulfonylamino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Openeye Name: ethyl (6S)-2-[(1-ethylpyrazol-4-yl)sulfonylamino]-6-methyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate CAS Name: (6S)-2-[(1-ethyl-4-pyrazolyl)sulfonylamino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid ethyl ester IUPAC Name: ethyl (6S)-2-[(1-ethylpyrazol-4-yl)sulfonylamino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Traditional Name: (6S)-2-[(1-ethylpyrazol-4-yl)sulfonylamino]-6-methyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid ethyl ester Formula: C17H23N3O4S2 MolecularWeight: 397.51222

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C=N1)S(=O)(=O)NC2=C(C3=C(S2)CC(CC3)C)C(=O)OCC

Isomeric SMILES

CCN1C=C(C=N1)S(=O)(=O)NC2=C(C3=C(S2)C[C@H](CC3)C)C(=O)OCC

InChI

InChI=1S/C17H23N3O4S2/c1-4-20-10-12(9-18-20)26(22,23)19-16-15(17(21)24-5-2)13-7-6-11(3)8-14(13)25-16/h9-11,19H,4-8H2,1-3H3/t11-/m0/s1