N-(4-butan-2-ylphenyl)-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Systemtic Name: N-(4-butan-2-ylphenyl)-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Openeye Name: 6-ethyl-N-(4-sec-butylphenyl)-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide CAS Name: N-(4-butan-2-ylphenyl)-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide IUPAC Name: N-(4-butan-2-ylphenyl)-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Traditional Name: 6-ethyl-N-(4-sec-butylphenyl)-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide Formula: C21H27NOS MolecularWeight: 341.51018

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCC2=C(C1)SC=C2C(=O)NC3=CC=C(C=C3)C(C)CC

Isomeric SMILES

CCC1CCC2=C(C1)SC=C2C(=O)NC3=CC=C(C=C3)C(C)CC

InChI

InChI=1S/C21H27NOS/c1-4-14(3)16-7-9-17(10-8-16)22-21(23)19-13-24-20-12-15(5-2)6-11-18(19)20/h7-10,13-15H,4-6,11-12H2,1-3H3,(H,22,23)