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

Systemtic Name: 6-tert-butyl-2-[2-(3-chloranylphenoxy)propanoylamino]-N-phenyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Openeye Name: 6-tert-butyl-2-[2-(3-chlorophenoxy)propanoylamino]-N-phenyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide CAS Name: 6-tert-butyl-2-[[2-(3-chlorophenoxy)-1-oxopropyl]amino]-N-phenyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide IUPAC Name: 6-tert-butyl-2-[2-(3-chlorophenoxy)propanoylamino]-N-phenyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Traditional Name: 6-tert-butyl-2-[2-(3-chlorophenoxy)propanoylamino]-N-phenyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide Formula: C28H31ClN2O3S MolecularWeight: 511.07534

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C2=C(S1)CC(CC2)C(C)(C)C)C(=O)NC3=CC=CC=C3)OC4=CC(=CC=C4)Cl

Isomeric SMILES

CC(C(=O)NC1=C(C2=C(S1)CC(CC2)C(C)(C)C)C(=O)NC3=CC=CC=C3)OC4=CC(=CC=C4)Cl

InChI

InChI=1S/C28H31ClN2O3S/c1-17(34-21-12-8-9-19(29)16-21)25(32)31-27-24(26(33)30-20-10-6-5-7-11-20)22-14-13-18(28(2,3)4)15-23(22)35-27/h5-12,16-18H,13-15H2,1-4H3,(H,30,33)(H,31,32)