N-[1-(3-methylbutyl)piperidin-4-yl]-N-[[4-[4-(4-oxidanylpiperidin-1-yl)carbonylphenyl]phenyl]methyl]-4-pentyl-thiophene-2-carboxamide

Systemtic Name: N-[1-(3-methylbutyl)piperidin-4-yl]-N-[[4-[4-(4-oxidanylpiperidin-1-yl)carbonylphenyl]phenyl]methyl]-4-pentyl-thiophene-2-carboxamide Openeye Name: N-[[4-[4-(4-hydroxypiperidine-1-carbonyl)phenyl]phenyl]methyl]-N-(1-isopentyl-4-piperidyl)-4-pentyl-thiophene-2-carboxamide CAS Name: N-[[4-[4-[(4-hydroxy-1-piperidinyl)-oxomethyl]phenyl]phenyl]methyl]-N-[1-(3-methylbutyl)-4-piperidinyl]-4-pentyl-2-thiophenecarboxamide IUPAC Name: N-[[4-[4-(4-hydroxypiperidine-1-carbonyl)phenyl]phenyl]methyl]-N-[1-(3-methylbutyl)piperidin-4-yl]-4-pentylthiophene-2-carboxamide Traditional Name: 4-amyl-N-[4-[4-(4-hydroxypiperidine-1-carbonyl)phenyl]benzyl]-N-(1-isoamyl-4-piperidyl)thiophene-2-carboxamide Formula: C39H53N3O3S MolecularWeight: 643.92142

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CSC(=C1)C(=O)N(CC2=CC=C(C=C2)C3=CC=C(C=C3)C(=O)N4CCC(CC4)O)C5CCN(CC5)CCC(C)C

Isomeric SMILES

CCCCCC1=CSC(=C1)C(=O)N(CC2=CC=C(C=C2)C3=CC=C(C=C3)C(=O)N4CCC(CC4)O)C5CCN(CC5)CCC(C)C

InChI

InChI=1S/C39H53N3O3S/c1-4-5-6-7-31-26-37(46-28-31)39(45)42(35-17-22-40(23-18-35)21-16-29(2)3)27-30-8-10-32(11-9-30)33-12-14-34(15-13-33)38(44)41-24-19-36(43)20-25-41/h8-15,26,28-29,35-36,43H,4-7,16-25,27H2,1-3H3