(4S)-4-methyl-2-pyrrol-1-yl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Systemtic Name: (4S)-4-methyl-2-pyrrol-1-yl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Openeye Name: (4S)-4-methyl-2-pyrrol-1-yl-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate CAS Name: (4S)-4-methyl-2-(1-pyrrolyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate IUPAC Name: (4S)-4-methyl-2-pyrrol-1-yl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Traditional Name: (4S)-4-methyl-2-pyrrol-1-yl-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate Formula: C14H14NO2S- MolecularWeight: 260.33146

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC2=C1C(=C(S2)N3C=CC=C3)C(=O)[O-]

Isomeric SMILES

C[C@H]1CCCC2=C1C(=C(S2)N3C=CC=C3)C(=O)[O-]

InChI

InChI=1S/C14H15NO2S/c1-9-5-4-6-10-11(9)12(14(16)17)13(18-10)15-7-2-3-8-15/h2-3,7-9H,4-6H2,1H3,(H,16,17)/p-1/t9-/m0/s1