1-ethyl-3-(4-ethylpiperazin-1-yl)carbonyl-6-pyrrolidin-1-ylsulfonyl-quinolin-4-one

Systemtic Name: 1-ethyl-3-(4-ethylpiperazin-1-yl)carbonyl-6-pyrrolidin-1-ylsulfonyl-quinolin-4-one Openeye Name: 1-ethyl-3-(4-ethylpiperazine-1-carbonyl)-6-pyrrolidin-1-ylsulfonyl-quinolin-4-one CAS Name: 1-ethyl-3-[(4-ethyl-1-piperazinyl)-oxomethyl]-6-(1-pyrrolidinylsulfonyl)-4-quinolinone IUPAC Name: 1-ethyl-3-(4-ethylpiperazine-1-carbonyl)-6-pyrrolidin-1-ylsulfonylquinolin-4-one Traditional Name: 1-ethyl-3-(4-ethylpiperazine-1-carbonyl)-6-pyrrolidinosulfonyl-4-quinolone Formula: C22H30N4O4S MolecularWeight: 446.563

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C(=O)C2=CN(C3=C(C2=O)C=C(C=C3)S(=O)(=O)N4CCCC4)CC

Isomeric SMILES

CCN1CCN(CC1)C(=O)C2=CN(C3=C(C2=O)C=C(C=C3)S(=O)(=O)N4CCCC4)CC

InChI

InChI=1S/C22H30N4O4S/c1-3-23-11-13-25(14-12-23)22(28)19-16-24(4-2)20-8-7-17(15-18(20)21(19)27)31(29,30)26-9-5-6-10-26/h7-8,15-16H,3-6,9-14H2,1-2H3