5-tert-butyl-N-[3-(2-methoxyethanoylamino)phenyl]-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide

Systemtic Name: 5-tert-butyl-N-[3-(2-methoxyethanoylamino)phenyl]-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide Openeye Name: 5-tert-butyl-N-[3-[(2-methoxyacetyl)amino]phenyl]-4,5,6,7-tetrahydrobenzothiophene-2-carboxamide CAS Name: 5-tert-butyl-N-[3-[(2-methoxy-1-oxoethyl)amino]phenyl]-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide IUPAC Name: 5-tert-butyl-N-[3-[(2-methoxyacetyl)amino]phenyl]-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide Traditional Name: 5-tert-butyl-N-[3-[(2-methoxyacetyl)amino]phenyl]-4,5,6,7-tetrahydrobenzothiophene-2-carboxamide Formula: C22H28N2O3S MolecularWeight: 400.53432

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CCC2=C(C1)C=C(S2)C(=O)NC3=CC(=CC=C3)NC(=O)COC

Isomeric SMILES

CC(C)(C)C1CCC2=C(C1)C=C(S2)C(=O)NC3=CC(=CC=C3)NC(=O)COC

InChI

InChI=1S/C22H28N2O3S/c1-22(2,3)15-8-9-18-14(10-15)11-19(28-18)21(26)24-17-7-5-6-16(12-17)23-20(25)13-27-4/h5-7,11-12,15H,8-10,13H2,1-4H3,(H,23,25)(H,24,26)