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

Systemtic Name: 2-[2-(3-chloranylphenoxy)propanoylamino]-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Openeye Name: 2-[2-(3-chlorophenoxy)propanoylamino]-6-ethyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide CAS Name: 2-[[2-(3-chlorophenoxy)-1-oxopropyl]amino]-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide IUPAC Name: 2-[2-(3-chlorophenoxy)propanoylamino]-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Traditional Name: 2-[2-(3-chlorophenoxy)propanoylamino]-6-ethyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide Formula: C20H23ClN2O3S MolecularWeight: 406.92622

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCC2=C(C1)SC(=C2C(=O)N)NC(=O)C(C)OC3=CC(=CC=C3)Cl

Isomeric SMILES

CCC1CCC2=C(C1)SC(=C2C(=O)N)NC(=O)C(C)OC3=CC(=CC=C3)Cl

InChI

InChI=1S/C20H23ClN2O3S/c1-3-12-7-8-15-16(9-12)27-20(17(15)18(22)24)23-19(25)11(2)26-14-6-4-5-13(21)10-14/h4-6,10-12H,3,7-9H2,1-2H3,(H2,22,24)(H,23,25)