N-(2,5-dimethylphenyl)-2-[4-(3-methylquinolin-8-yl)sulfonylpiperazin-1-yl]propanamide

Systemtic Name: N-(2,5-dimethylphenyl)-2-[4-(3-methylquinolin-8-yl)sulfonylpiperazin-1-yl]propanamide Openeye Name: N-(2,5-dimethylphenyl)-2-[4-[(3-methyl-8-quinolyl)sulfonyl]piperazin-1-yl]propanamide CAS Name: N-(2,5-dimethylphenyl)-2-[4-[(3-methyl-8-quinolinyl)sulfonyl]-1-piperazinyl]propanamide IUPAC Name: N-(2,5-dimethylphenyl)-2-[4-(3-methylquinolin-8-yl)sulfonylpiperazin-1-yl]propanamide Traditional Name: N-(2,5-dimethylphenyl)-2-[4-[(3-methyl-8-quinolyl)sulfonyl]piperazino]propionamide Formula: C25H30N4O3S MolecularWeight: 466.5957

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NC(=O)C(C)N2CCN(CC2)S(=O)(=O)C3=CC=CC4=CC(=CN=C43)C

Isomeric SMILES

CC1=CC(=C(C=C1)C)NC(=O)C(C)N2CCN(CC2)S(=O)(=O)C3=CC=CC4=CC(=CN=C43)C

InChI

InChI=1S/C25H30N4O3S/c1-17-8-9-19(3)22(15-17)27-25(30)20(4)28-10-12-29(13-11-28)33(31,32)23-7-5-6-21-14-18(2)16-26-24(21)23/h5-9,14-16,20H,10-13H2,1-4H3,(H,27,30)