3-[3-[6-[3-(dimethylamino)propoxy]quinolin-4-yl]pyrazol-1-yl]sulfonylbenzenecarbonitrile

Systemtic Name: 3-[3-[6-[3-(dimethylamino)propoxy]quinolin-4-yl]pyrazol-1-yl]sulfonylbenzenecarbonitrile Openeye Name: 3-[3-[6-[3-(dimethylamino)propoxy]-4-quinolyl]pyrazol-1-yl]sulfonylbenzonitrile CAS Name: 3-[[3-[6-[3-(dimethylamino)propoxy]-4-quinolinyl]-1-pyrazolyl]sulfonyl]benzonitrile IUPAC Name: 3-[3-[6-[3-(dimethylamino)propoxy]quinolin-4-yl]pyrazol-1-yl]sulfonylbenzonitrile Traditional Name: 3-[3-[6-[3-(dimethylamino)propoxy]-4-quinolyl]pyrazol-1-yl]sulfonylbenzonitrile Formula: C24H23N5O3S MolecularWeight: 461.53612

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCOC1=CC2=C(C=CN=C2C=C1)C3=NN(C=C3)S(=O)(=O)C4=CC=CC(=C4)C#N

Isomeric SMILES

CN(C)CCCOC1=CC2=C(C=CN=C2C=C1)C3=NN(C=C3)S(=O)(=O)C4=CC=CC(=C4)C#N

InChI

InChI=1S/C24H23N5O3S/c1-28(2)12-4-14-32-19-7-8-23-22(16-19)21(9-11-26-23)24-10-13-29(27-24)33(30,31)20-6-3-5-18(15-20)17-25/h3,5-11,13,15-16H,4,12,14H2,1-2H3