6-(azepan-1-ylsulfonyl)-3-(4-ethylpiperazin-1-yl)carbonyl-1-methyl-quinolin-4-one

Systemtic Name: 6-(azepan-1-ylsulfonyl)-3-(4-ethylpiperazin-1-yl)carbonyl-1-methyl-quinolin-4-one Openeye Name: 6-(azepan-1-ylsulfonyl)-3-(4-ethylpiperazine-1-carbonyl)-1-methyl-quinolin-4-one CAS Name: 6-(1-azepanylsulfonyl)-3-[(4-ethyl-1-piperazinyl)-oxomethyl]-1-methyl-4-quinolinone IUPAC Name: 6-(azepan-1-ylsulfonyl)-3-(4-ethylpiperazine-1-carbonyl)-1-methylquinolin-4-one Traditional Name: 6-(azepan-1-ylsulfonyl)-3-(4-ethylpiperazine-1-carbonyl)-1-methyl-4-quinolone Formula: C23H32N4O4S MolecularWeight: 460.58958

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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)N4CCCCCC4)C

Isomeric SMILES

CCN1CCN(CC1)C(=O)C2=CN(C3=C(C2=O)C=C(C=C3)S(=O)(=O)N4CCCCCC4)C

InChI

InChI=1S/C23H32N4O4S/c1-3-25-12-14-26(15-13-25)23(29)20-17-24(2)21-9-8-18(16-19(21)22(20)28)32(30,31)27-10-6-4-5-7-11-27/h8-9,16-17H,3-7,10-15H2,1-2H3