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

Systemtic Name: 2-[2-(4-chloranyl-3,5-dimethyl-phenoxy)propanoylamino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Openeye Name: 2-[2-(4-chloro-3,5-dimethyl-phenoxy)propanoylamino]-6-methyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide CAS Name: 2-[[2-(4-chloro-3,5-dimethylphenoxy)-1-oxopropyl]amino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide IUPAC Name: 2-[2-(4-chloro-3,5-dimethylphenoxy)propanoylamino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Traditional Name: 2-[2-(4-chloro-3,5-dimethyl-phenoxy)propanoylamino]-6-methyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide Formula: C21H25ClN2O3S MolecularWeight: 420.9528

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)SC(=C2C(=O)N)NC(=O)C(C)OC3=CC(=C(C(=C3)C)Cl)C

Isomeric SMILES

CC1CCC2=C(C1)SC(=C2C(=O)N)NC(=O)C(C)OC3=CC(=C(C(=C3)C)Cl)C

InChI

InChI=1S/C21H25ClN2O3S/c1-10-5-6-15-16(7-10)28-21(17(15)19(23)25)24-20(26)13(4)27-14-8-11(2)18(22)12(3)9-14/h8-10,13H,5-7H2,1-4H3,(H2,23,25)(H,24,26)