N-(3-acetamido-4-methoxy-phenyl)-5-tert-butyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide

Systemtic Name: N-(3-acetamido-4-methoxy-phenyl)-5-tert-butyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide Openeye Name: N-(3-acetamido-4-methoxy-phenyl)-5-tert-butyl-4,5,6,7-tetrahydrobenzothiophene-2-carboxamide CAS Name: N-(3-acetamido-4-methoxyphenyl)-5-tert-butyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide IUPAC Name: N-(3-acetamido-4-methoxyphenyl)-5-tert-butyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide Traditional Name: N-(3-acetamido-4-methoxy-phenyl)-5-tert-butyl-4,5,6,7-tetrahydrobenzothiophene-2-carboxamide Formula: C22H28N2O3S MolecularWeight: 400.53432

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=CC(=C1)NC(=O)C2=CC3=C(S2)CCC(C3)C(C)(C)C)OC

Isomeric SMILES

CC(=O)NC1=C(C=CC(=C1)NC(=O)C2=CC3=C(S2)CCC(C3)C(C)(C)C)OC

InChI

InChI=1S/C22H28N2O3S/c1-13(25)23-17-12-16(7-8-18(17)27-5)24-21(26)20-11-14-10-15(22(2,3)4)6-9-19(14)28-20/h7-8,11-12,15H,6,9-10H2,1-5H3,(H,23,25)(H,24,26)