1-[3-[[3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)thiophen-2-yl]carbonylamino]propyl]piperidine-4-carboxamide

Systemtic Name: 1-[3-[[3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)thiophen-2-yl]carbonylamino]propyl]piperidine-4-carboxamide Openeye Name: 1-[3-[[3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)thiophene-2-carbonyl]amino]propyl]piperidine-4-carboxamide CAS Name: 1-[3-[[[3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-2-thiophenyl]-oxomethyl]amino]propyl]-4-piperidinecarboxamide IUPAC Name: 1-[3-[[3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)thiophene-2-carbonyl]amino]propyl]piperidine-4-carboxamide Traditional Name: 1-[3-[[3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)thiophene-2-carbonyl]amino]propyl]isonipecotamide Formula: C23H30N4O4S2 MolecularWeight: 490.6387

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)N)CCCNC(=O)C2=C(C=CS2)S(=O)(=O)N3CCC4=CC=CC=C4C3

Isomeric SMILES

C1CN(CCC1C(=O)N)CCCNC(=O)C2=C(C=CS2)S(=O)(=O)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C23H30N4O4S2/c24-22(28)18-6-12-26(13-7-18)11-3-10-25-23(29)21-20(9-15-32-21)33(30,31)27-14-8-17-4-1-2-5-19(17)16-27/h1-2,4-5,9,15,18H,3,6-8,10-14,16H2,(H2,24,28)(H,25,29)