[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]-(2-propan-2-ylquinolin-4-yl)methanone

Systemtic Name: [4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]-(2-propan-2-ylquinolin-4-yl)methanone Openeye Name: [4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]-(2-isopropyl-4-quinolyl)methanone CAS Name: [4-(2,4-dimethylphenyl)sulfonyl-1-piperazinyl]-(2-propan-2-yl-4-quinolinyl)methanone IUPAC Name: [4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]-(2-propan-2-ylquinolin-4-yl)methanone Traditional Name: [4-(2,4-dimethylphenyl)sulfonylpiperazino]-(2-isopropyl-4-quinolyl)methanone Formula: C25H29N3O3S MolecularWeight: 451.58106

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC(=NC4=CC=CC=C43)C(C)C)C

Isomeric SMILES

CC1=CC(=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC(=NC4=CC=CC=C43)C(C)C)C

InChI

InChI=1S/C25H29N3O3S/c1-17(2)23-16-21(20-7-5-6-8-22(20)26-23)25(29)27-11-13-28(14-12-27)32(30,31)24-10-9-18(3)15-19(24)4/h5-10,15-17H,11-14H2,1-4H3