6-methoxy-N-[(5-pyrrolidin-1-ylsulfonylthiophen-2-yl)methyl]quinoline-2-carboxamide

Systemtic Name: 6-methoxy-N-[(5-pyrrolidin-1-ylsulfonylthiophen-2-yl)methyl]quinoline-2-carboxamide Openeye Name: 6-methoxy-N-[(5-pyrrolidin-1-ylsulfonyl-2-thienyl)methyl]quinoline-2-carboxamide CAS Name: 6-methoxy-N-[[5-(1-pyrrolidinylsulfonyl)-2-thiophenyl]methyl]-2-quinolinecarboxamide IUPAC Name: 6-methoxy-N-[(5-pyrrolidin-1-ylsulfonylthiophen-2-yl)methyl]quinoline-2-carboxamide Traditional Name: 6-methoxy-N-[(5-pyrrolidinosulfonyl-2-thienyl)methyl]quinaldamide Formula: C20H21N3O4S2 MolecularWeight: 431.52844

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N=C(C=C2)C(=O)NCC3=CC=C(S3)S(=O)(=O)N4CCCC4

Isomeric SMILES

COC1=CC2=C(C=C1)N=C(C=C2)C(=O)NCC3=CC=C(S3)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C20H21N3O4S2/c1-27-15-5-8-17-14(12-15)4-7-18(22-17)20(24)21-13-16-6-9-19(28-16)29(25,26)23-10-2-3-11-23/h4-9,12H,2-3,10-11,13H2,1H3,(H,21,24)