N-[4-azanyl-3,4-bis(oxidanylidene)-1-phenyl-butan-2-yl]-1-(1-benzothiophen-2-ylcarbonyl)piperidine-4-carboxamide

Systemtic Name: N-[4-azanyl-3,4-bis(oxidanylidene)-1-phenyl-butan-2-yl]-1-(1-benzothiophen-2-ylcarbonyl)piperidine-4-carboxamide Openeye Name: N-(3-amino-1-benzyl-2,3-dioxo-propyl)-1-(benzothiophene-2-carbonyl)piperidine-4-carboxamide CAS Name: N-(4-amino-3,4-dioxo-1-phenylbutan-2-yl)-1-[1-benzothiophen-2-yl(oxo)methyl]-4-piperidinecarboxamide IUPAC Name: N-(4-amino-3,4-dioxo-1-phenylbutan-2-yl)-1-(1-benzothiophene-2-carbonyl)piperidine-4-carboxamide Traditional Name: N-(3-amino-1-benzyl-2,3-diketo-propyl)-1-(benzothiophene-2-carbonyl)isonipecotamide Formula: C25H25N3O4S MolecularWeight: 463.5487

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC(CC2=CC=CC=C2)C(=O)C(=O)N)C(=O)C3=CC4=CC=CC=C4S3

Isomeric SMILES

C1CN(CCC1C(=O)NC(CC2=CC=CC=C2)C(=O)C(=O)N)C(=O)C3=CC4=CC=CC=C4S3

InChI

InChI=1S/C25H25N3O4S/c26-23(30)22(29)19(14-16-6-2-1-3-7-16)27-24(31)17-10-12-28(13-11-17)25(32)21-15-18-8-4-5-9-20(18)33-21/h1-9,15,17,19H,10-14H2,(H2,26,30)(H,27,31)