(4-phenylpiperazin-1-yl)-[1-(6-pyrrolidin-1-ylsulfonylquinolin-2-yl)piperidin-3-yl]methanone

Systemtic Name: (4-phenylpiperazin-1-yl)-[1-(6-pyrrolidin-1-ylsulfonylquinolin-2-yl)piperidin-3-yl]methanone Openeye Name: (4-phenylpiperazin-1-yl)-[1-(6-pyrrolidin-1-ylsulfonyl-2-quinolyl)-3-piperidyl]methanone CAS Name: (4-phenyl-1-piperazinyl)-[1-[6-(1-pyrrolidinylsulfonyl)-2-quinolinyl]-3-piperidinyl]methanone IUPAC Name: (4-phenylpiperazin-1-yl)-[1-(6-pyrrolidin-1-ylsulfonylquinolin-2-yl)piperidin-3-yl]methanone Traditional Name: (4-phenylpiperazino)-[1-(6-pyrrolidinosulfonyl-2-quinolyl)-3-piperidyl]methanone Formula: C29H35N5O3S MolecularWeight: 533.6849

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC3=C(C=C2)N=C(C=C3)N4CCCC(C4)C(=O)N5CCN(CC5)C6=CC=CC=C6

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC3=C(C=C2)N=C(C=C3)N4CCCC(C4)C(=O)N5CCN(CC5)C6=CC=CC=C6

InChI

InChI=1S/C29H35N5O3S/c35-29(32-19-17-31(18-20-32)25-8-2-1-3-9-25)24-7-6-14-33(22-24)28-13-10-23-21-26(11-12-27(23)30-28)38(36,37)34-15-4-5-16-34/h1-3,8-13,21,24H,4-7,14-20,22H2