N-[4-[[2-(4-methoxyphenyl)-2-piperidin-1-yl-ethyl]amino]-4-oxidanylidene-butyl]thiophene-2-carboxamide

Systemtic Name: N-[4-[[2-(4-methoxyphenyl)-2-piperidin-1-yl-ethyl]amino]-4-oxidanylidene-butyl]thiophene-2-carboxamide Openeye Name: N-[4-[[2-(4-methoxyphenyl)-2-(1-piperidyl)ethyl]amino]-4-oxo-butyl]thiophene-2-carboxamide CAS Name: N-[4-[[2-(4-methoxyphenyl)-2-(1-piperidinyl)ethyl]amino]-4-oxobutyl]-2-thiophenecarboxamide IUPAC Name: N-[4-[[2-(4-methoxyphenyl)-2-piperidin-1-ylethyl]amino]-4-oxobutyl]thiophene-2-carboxamide Traditional Name: N-[4-keto-4-[[2-(4-methoxyphenyl)-2-piperidino-ethyl]amino]butyl]thiophene-2-carboxamide Formula: C23H31N3O3S MolecularWeight: 429.57554

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(CNC(=O)CCCNC(=O)C2=CC=CS2)N3CCCCC3

Isomeric SMILES

COC1=CC=C(C=C1)C(CNC(=O)CCCNC(=O)C2=CC=CS2)N3CCCCC3

InChI

InChI=1S/C23H31N3O3S/c1-29-19-11-9-18(10-12-19)20(26-14-3-2-4-15-26)17-25-22(27)8-5-13-24-23(28)21-7-6-16-30-21/h6-7,9-12,16,20H,2-5,8,13-15,17H2,1H3,(H,24,28)(H,25,27)