(2-cyclopropylquinolin-4-yl)-[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]methanone

Systemtic Name: (2-cyclopropylquinolin-4-yl)-[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]methanone Openeye Name: (2-cyclopropyl-4-quinolyl)-[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]methanone CAS Name: (2-cyclopropyl-4-quinolinyl)-[4-(4-ethoxyphenyl)sulfonyl-1-piperazinyl]methanone IUPAC Name: (2-cyclopropylquinolin-4-yl)-[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]methanone Traditional Name: (2-cyclopropyl-4-quinolyl)-(4-p-phenetylsulfonylpiperazino)methanone Formula: C25H27N3O4S MolecularWeight: 465.56458

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC(=NC4=CC=CC=C43)C5CC5

Isomeric SMILES

CCOC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC(=NC4=CC=CC=C43)C5CC5

InChI

InChI=1S/C25H27N3O4S/c1-2-32-19-9-11-20(12-10-19)33(30,31)28-15-13-27(14-16-28)25(29)22-17-24(18-7-8-18)26-23-6-4-3-5-21(22)23/h3-6,9-12,17-18H,2,7-8,13-16H2,1H3