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

Systemtic Name: 2-[2-(3-chloranylphenoxy)propanoylamino]-6-propyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Openeye Name: 2-[2-(3-chlorophenoxy)propanoylamino]-6-propyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide CAS Name: 2-[[2-(3-chlorophenoxy)-1-oxopropyl]amino]-6-propyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide IUPAC Name: 2-[2-(3-chlorophenoxy)propanoylamino]-6-propyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Traditional Name: 2-[2-(3-chlorophenoxy)propanoylamino]-6-propyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide Formula: C21H25ClN2O3S MolecularWeight: 420.9528

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H25ClN2O3S/c1-3-5-13-8-9-16-17(10-13)28-21(18(16)19(23)25)24-20(26)12(2)27-15-7-4-6-14(22)11-15/h4,6-7,11-13H,3,5,8-10H2,1-2H3,(H2,23,25)(H,24,26)