N-(4-ethylphenyl)-2-[[5-[(5R)-5-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-1,3,4-oxadiazol-2-yl]sulfanyl]ethanamide

Systemtic Name: N-(4-ethylphenyl)-2-[[5-[(5R)-5-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-1,3,4-oxadiazol-2-yl]sulfanyl]ethanamide Openeye Name: N-(4-ethylphenyl)-2-[[5-[(5R)-5-methyl-4,5,6,7-tetrahydrobenzothiophen-2-yl]-1,3,4-oxadiazol-2-yl]sulfanyl]acetamide CAS Name: N-(4-ethylphenyl)-2-[[5-[(5R)-5-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-1,3,4-oxadiazol-2-yl]thio]acetamide IUPAC Name: N-(4-ethylphenyl)-2-[[5-[(5R)-5-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-1,3,4-oxadiazol-2-yl]sulfanyl]acetamide Traditional Name: N-(4-ethylphenyl)-2-[[5-[(5R)-5-methyl-4,5,6,7-tetrahydrobenzothiophen-2-yl]-1,3,4-oxadiazol-2-yl]thio]acetamide Formula: C21H23N3O2S2 MolecularWeight: 413.55622

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=O)CSC2=NN=C(O2)C3=CC4=C(S3)CCC(C4)C

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=O)CSC2=NN=C(O2)C3=CC4=C(S3)CC[C@H](C4)C

InChI

InChI=1S/C21H23N3O2S2/c1-3-14-5-7-16(8-6-14)22-19(25)12-27-21-24-23-20(26-21)18-11-15-10-13(2)4-9-17(15)28-18/h5-8,11,13H,3-4,9-10,12H2,1-2H3,(H,22,25)/t13-/m1/s1