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

Systemtic Name: 2-[3-(4-methoxyphenyl)propanoylamino]-6-propyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Openeye Name: 2-[3-(4-methoxyphenyl)propanoylamino]-6-propyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide CAS Name: 2-[[3-(4-methoxyphenyl)-1-oxopropyl]amino]-6-propyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide IUPAC Name: 2-[3-(4-methoxyphenyl)propanoylamino]-6-propyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Traditional Name: 2-[3-(4-methoxyphenyl)propanoylamino]-6-propyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide Formula: C22H28N2O3S MolecularWeight: 400.53432

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1CCC2=C(C1)SC(=C2C(=O)N)NC(=O)CCC3=CC=C(C=C3)OC

Isomeric SMILES

CCCC1CCC2=C(C1)SC(=C2C(=O)N)NC(=O)CCC3=CC=C(C=C3)OC

InChI

InChI=1S/C22H28N2O3S/c1-3-4-15-7-11-17-18(13-15)28-22(20(17)21(23)26)24-19(25)12-8-14-5-9-16(27-2)10-6-14/h5-6,9-10,15H,3-4,7-8,11-13H2,1-2H3,(H2,23,26)(H,24,25)