2-[(5-bromanyl-2-methoxy-3-methyl-phenyl)carbonylamino]-6-tert-butyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Systemtic Name: 2-[(5-bromanyl-2-methoxy-3-methyl-phenyl)carbonylamino]-6-tert-butyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Openeye Name: 2-[(5-bromo-2-methoxy-3-methyl-benzoyl)amino]-6-tert-butyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide CAS Name: 2-[[(5-bromo-2-methoxy-3-methylphenyl)-oxomethyl]amino]-6-tert-butyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide IUPAC Name: 2-[(5-bromo-2-methoxy-3-methylbenzoyl)amino]-6-tert-butyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Traditional Name: 2-[(5-bromo-2-methoxy-3-methyl-benzoyl)amino]-6-tert-butyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide Formula: C22H27BrN2O3S MolecularWeight: 479.43038

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)Br)C(=O)NC2=C(C3=C(S2)CC(CC3)C(C)(C)C)C(=O)N)OC

Isomeric SMILES

CC1=C(C(=CC(=C1)Br)C(=O)NC2=C(C3=C(S2)CC(CC3)C(C)(C)C)C(=O)N)OC

InChI

InChI=1S/C22H27BrN2O3S/c1-11-8-13(23)10-15(18(11)28-5)20(27)25-21-17(19(24)26)14-7-6-12(22(2,3)4)9-16(14)29-21/h8,10,12H,6-7,9H2,1-5H3,(H2,24,26)(H,25,27)