N-[3-(3-ethoxypropylcarbamoyl)-4-[4-(phenylmethyl)piperidin-1-yl]phenyl]thiophene-2-carboxamide

Systemtic Name: N-[3-(3-ethoxypropylcarbamoyl)-4-[4-(phenylmethyl)piperidin-1-yl]phenyl]thiophene-2-carboxamide Openeye Name: N-[4-(4-benzyl-1-piperidyl)-3-(3-ethoxypropylcarbamoyl)phenyl]thiophene-2-carboxamide CAS Name: N-[3-[(3-ethoxypropylamino)-oxomethyl]-4-[4-(phenylmethyl)-1-piperidinyl]phenyl]-2-thiophenecarboxamide IUPAC Name: N-[4-(4-benzylpiperidin-1-yl)-3-(3-ethoxypropylcarbamoyl)phenyl]thiophene-2-carboxamide Traditional Name: N-[4-(4-benzylpiperidino)-3-(3-ethoxypropylcarbamoyl)phenyl]thiophene-2-carboxamide Formula: C29H35N3O3S MolecularWeight: 505.6715

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCCNC(=O)C1=C(C=CC(=C1)NC(=O)C2=CC=CS2)N3CCC(CC3)CC4=CC=CC=C4

Isomeric SMILES

CCOCCCNC(=O)C1=C(C=CC(=C1)NC(=O)C2=CC=CS2)N3CCC(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C29H35N3O3S/c1-2-35-18-7-15-30-28(33)25-21-24(31-29(34)27-10-6-19-36-27)11-12-26(25)32-16-13-23(14-17-32)20-22-8-4-3-5-9-22/h3-6,8-12,19,21,23H,2,7,13-18,20H2,1H3,(H,30,33)(H,31,34)