3-[4-(3-methylquinolin-8-yl)sulfonylpiperazin-1-yl]butanenitrile

Systemtic Name: 3-[4-(3-methylquinolin-8-yl)sulfonylpiperazin-1-yl]butanenitrile Openeye Name: 3-[4-[(3-methyl-8-quinolyl)sulfonyl]piperazin-1-yl]butanenitrile CAS Name: 3-[4-[(3-methyl-8-quinolinyl)sulfonyl]-1-piperazinyl]butanenitrile IUPAC Name: 3-[4-(3-methylquinolin-8-yl)sulfonylpiperazin-1-yl]butanenitrile Traditional Name: 3-[4-[(3-methyl-8-quinolyl)sulfonyl]piperazino]butyronitrile Formula: C18H22N4O2S MolecularWeight: 358.45788

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C2C(=C1)C=CC=C2S(=O)(=O)N3CCN(CC3)C(C)CC#N

Isomeric SMILES

CC1=CN=C2C(=C1)C=CC=C2S(=O)(=O)N3CCN(CC3)C(C)CC#N

InChI

InChI=1S/C18H22N4O2S/c1-14-12-16-4-3-5-17(18(16)20-13-14)25(23,24)22-10-8-21(9-11-22)15(2)6-7-19/h3-5,12-13,15H,6,8-11H2,1-2H3