2-[2-(4-chloranyl-2-methyl-phenoxy)propanoylamino]-6-propyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Systemtic Name: 2-[2-(4-chloranyl-2-methyl-phenoxy)propanoylamino]-6-propyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Openeye Name: 2-[2-(4-chloro-2-methyl-phenoxy)propanoylamino]-6-propyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide CAS Name: 2-[[2-(4-chloro-2-methylphenoxy)-1-oxopropyl]amino]-6-propyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide IUPAC Name: 2-[2-(4-chloro-2-methylphenoxy)propanoylamino]-6-propyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Traditional Name: 2-[2-(4-chloro-2-methyl-phenoxy)propanoylamino]-6-propyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide Formula: C22H27ClN2O3S MolecularWeight: 434.97938

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1CCC2=C(C1)SC(=C2C(=O)N)NC(=O)C(C)OC3=C(C=C(C=C3)Cl)C

Isomeric SMILES

CCCC1CCC2=C(C1)SC(=C2C(=O)N)NC(=O)C(C)OC3=C(C=C(C=C3)Cl)C

InChI

InChI=1S/C22H27ClN2O3S/c1-4-5-14-6-8-16-18(11-14)29-22(19(16)20(24)26)25-21(27)13(3)28-17-9-7-15(23)10-12(17)2/h7,9-10,13-14H,4-6,8,11H2,1-3H3,(H2,24,26)(H,25,27)