1-(1H-indol-3-yl)-2-[4-(3-methylquinolin-8-yl)sulfonylpiperazin-1-yl]propan-1-one

Systemtic Name: 1-(1H-indol-3-yl)-2-[4-(3-methylquinolin-8-yl)sulfonylpiperazin-1-yl]propan-1-one Openeye Name: 1-(1H-indol-3-yl)-2-[4-[(3-methyl-8-quinolyl)sulfonyl]piperazin-1-yl]propan-1-one CAS Name: 1-(1H-indol-3-yl)-2-[4-[(3-methyl-8-quinolinyl)sulfonyl]-1-piperazinyl]-1-propanone IUPAC Name: 1-(1H-indol-3-yl)-2-[4-(3-methylquinolin-8-yl)sulfonylpiperazin-1-yl]propan-1-one Traditional Name: 1-(1H-indol-3-yl)-2-[4-[(3-methyl-8-quinolyl)sulfonyl]piperazino]propan-1-one Formula: C25H26N4O3S MolecularWeight: 462.56394

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C2C(=C1)C=CC=C2S(=O)(=O)N3CCN(CC3)C(C)C(=O)C4=CNC5=CC=CC=C54

Isomeric SMILES

CC1=CN=C2C(=C1)C=CC=C2S(=O)(=O)N3CCN(CC3)C(C)C(=O)C4=CNC5=CC=CC=C54

InChI

InChI=1S/C25H26N4O3S/c1-17-14-19-6-5-9-23(24(19)27-15-17)33(31,32)29-12-10-28(11-13-29)18(2)25(30)21-16-26-22-8-4-3-7-20(21)22/h3-9,14-16,18,26H,10-13H2,1-2H3