6-ethyl-N-[5-(phenylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Systemtic Name: 6-ethyl-N-[5-(phenylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Openeye Name: N-(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)-6-ethyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide CAS Name: 6-ethyl-N-[5-(phenylmethylthio)-1,3,4-thiadiazol-2-yl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide IUPAC Name: N-(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Traditional Name: N-[5-(benzylthio)-1,3,4-thiadiazol-2-yl]-6-ethyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide Formula: C20H21N3OS3 MolecularWeight: 415.59524

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCC2=C(C1)SC=C2C(=O)NC3=NN=C(S3)SCC4=CC=CC=C4

Isomeric SMILES

CCC1CCC2=C(C1)SC=C2C(=O)NC3=NN=C(S3)SCC4=CC=CC=C4

InChI

InChI=1S/C20H21N3OS3/c1-2-13-8-9-15-16(12-25-17(15)10-13)18(24)21-19-22-23-20(27-19)26-11-14-6-4-3-5-7-14/h3-7,12-13H,2,8-11H2,1H3,(H,21,22,24)