N-cycloheptyl-6-(4-methylpiperazin-1-yl)sulfonyl-4-oxidanylidene-1H-quinoline-3-carboxamide

Systemtic Name: N-cycloheptyl-6-(4-methylpiperazin-1-yl)sulfonyl-4-oxidanylidene-1H-quinoline-3-carboxamide Openeye Name: N-cycloheptyl-6-(4-methylpiperazin-1-yl)sulfonyl-4-oxo-1H-quinoline-3-carboxamide CAS Name: N-cycloheptyl-6-[(4-methyl-1-piperazinyl)sulfonyl]-4-oxo-1H-quinoline-3-carboxamide IUPAC Name: N-cycloheptyl-6-(4-methylpiperazin-1-yl)sulfonyl-4-oxo-1H-quinoline-3-carboxamide Traditional Name: N-cycloheptyl-4-keto-6-(4-methylpiperazino)sulfonyl-1H-quinoline-3-carboxamide Formula: C22H30N4O4S MolecularWeight: 446.563

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)NC=C(C3=O)C(=O)NC4CCCCCC4

Isomeric SMILES

CN1CCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)NC=C(C3=O)C(=O)NC4CCCCCC4

InChI

InChI=1S/C22H30N4O4S/c1-25-10-12-26(13-11-25)31(29,30)17-8-9-20-18(14-17)21(27)19(15-23-20)22(28)24-16-6-4-2-3-5-7-16/h8-9,14-16H,2-7,10-13H2,1H3,(H,23,27)(H,24,28)