N-butyl-2-[2-(4-methoxyphenyl)ethanoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Systemtic Name: N-butyl-2-[2-(4-methoxyphenyl)ethanoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Openeye Name: N-butyl-2-[[2-(4-methoxyphenyl)acetyl]amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide CAS Name: N-butyl-2-[[2-(4-methoxyphenyl)-1-oxoethyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide IUPAC Name: N-butyl-2-[[2-(4-methoxyphenyl)acetyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Traditional Name: N-butyl-2-[[2-(4-methoxyphenyl)acetyl]amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide Formula: C22H28N2O3S MolecularWeight: 400.53432

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1=C(SC2=C1CCCC2)NC(=O)CC3=CC=C(C=C3)OC

Isomeric SMILES

CCCCNC(=O)C1=C(SC2=C1CCCC2)NC(=O)CC3=CC=C(C=C3)OC

InChI

InChI=1S/C22H28N2O3S/c1-3-4-13-23-21(26)20-17-7-5-6-8-18(17)28-22(20)24-19(25)14-15-9-11-16(27-2)12-10-15/h9-12H,3-8,13-14H2,1-2H3,(H,23,26)(H,24,25)