1-(6-pyrrolidin-1-ylsulfonyl-3,4-dihydro-2H-quinolin-1-yl)-4-thiophen-2-yl-butan-1-one

Systemtic Name: 1-(6-pyrrolidin-1-ylsulfonyl-3,4-dihydro-2H-quinolin-1-yl)-4-thiophen-2-yl-butan-1-one Openeye Name: 1-(6-pyrrolidin-1-ylsulfonyl-3,4-dihydro-2H-quinolin-1-yl)-4-(2-thienyl)butan-1-one CAS Name: 1-[6-(1-pyrrolidinylsulfonyl)-3,4-dihydro-2H-quinolin-1-yl]-4-thiophen-2-yl-1-butanone IUPAC Name: 1-(6-pyrrolidin-1-ylsulfonyl-3,4-dihydro-2H-quinolin-1-yl)-4-thiophen-2-ylbutan-1-one Traditional Name: 1-(6-pyrrolidinosulfonyl-3,4-dihydro-2H-quinolin-1-yl)-4-(2-thienyl)butan-1-one Formula: C21H26N2O3S2 MolecularWeight: 418.57274

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC3=C(C=C2)N(CCC3)C(=O)CCCC4=CC=CS4

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC3=C(C=C2)N(CCC3)C(=O)CCCC4=CC=CS4

InChI

InChI=1S/C21H26N2O3S2/c24-21(9-3-7-18-8-5-15-27-18)23-14-4-6-17-16-19(10-11-20(17)23)28(25,26)22-12-1-2-13-22/h5,8,10-11,15-16H,1-4,6-7,9,12-14H2