3-methyl-N-[(5-pyrrolidin-1-ylsulfonylthiophen-2-yl)methyl]quinoline-8-sulfonamide

Systemtic Name: 3-methyl-N-[(5-pyrrolidin-1-ylsulfonylthiophen-2-yl)methyl]quinoline-8-sulfonamide Openeye Name: 3-methyl-N-[(5-pyrrolidin-1-ylsulfonyl-2-thienyl)methyl]quinoline-8-sulfonamide CAS Name: 3-methyl-N-[[5-(1-pyrrolidinylsulfonyl)-2-thiophenyl]methyl]-8-quinolinesulfonamide IUPAC Name: 3-methyl-N-[(5-pyrrolidin-1-ylsulfonylthiophen-2-yl)methyl]quinoline-8-sulfonamide Traditional Name: 3-methyl-N-[(5-pyrrolidinosulfonyl-2-thienyl)methyl]quinoline-8-sulfonamide Formula: C19H21N3O4S3 MolecularWeight: 451.58274

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C2C(=C1)C=CC=C2S(=O)(=O)NCC3=CC=C(S3)S(=O)(=O)N4CCCC4

Isomeric SMILES

CC1=CN=C2C(=C1)C=CC=C2S(=O)(=O)NCC3=CC=C(S3)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C19H21N3O4S3/c1-14-11-15-5-4-6-17(19(15)20-12-14)28(23,24)21-13-16-7-8-18(27-16)29(25,26)22-9-2-3-10-22/h4-8,11-12,21H,2-3,9-10,13H2,1H3