(5S)-5-methyl-N-(4-phenoxyphenyl)-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide

Systemtic Name: (5S)-5-methyl-N-(4-phenoxyphenyl)-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide Openeye Name: (5S)-5-methyl-N-(4-phenoxyphenyl)-4,5,6,7-tetrahydrobenzothiophene-2-carboxamide CAS Name: (5S)-5-methyl-N-(4-phenoxyphenyl)-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide IUPAC Name: (5S)-5-methyl-N-(4-phenoxyphenyl)-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide Traditional Name: (5S)-5-methyl-N-(4-phenoxyphenyl)-4,5,6,7-tetrahydrobenzothiophene-2-carboxamide Formula: C22H21NO2S MolecularWeight: 363.47264

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)C=C(S2)C(=O)NC3=CC=C(C=C3)OC4=CC=CC=C4

Isomeric SMILES

C[C@H]1CCC2=C(C1)C=C(S2)C(=O)NC3=CC=C(C=C3)OC4=CC=CC=C4

InChI

InChI=1S/C22H21NO2S/c1-15-7-12-20-16(13-15)14-21(26-20)22(24)23-17-8-10-19(11-9-17)25-18-5-3-2-4-6-18/h2-6,8-11,14-15H,7,12-13H2,1H3,(H,23,24)/t15-/m0/s1