(1-methyl-5-piperidin-1-ylsulfonyl-indol-2-yl)-(4-phenylpiperazin-1-yl)methanone

Systemtic Name: (1-methyl-5-piperidin-1-ylsulfonyl-indol-2-yl)-(4-phenylpiperazin-1-yl)methanone Openeye Name: [1-methyl-5-(1-piperidylsulfonyl)indol-2-yl]-(4-phenylpiperazin-1-yl)methanone CAS Name: [1-methyl-5-(1-piperidinylsulfonyl)-2-indolyl]-(4-phenyl-1-piperazinyl)methanone IUPAC Name: (1-methyl-5-piperidin-1-ylsulfonylindol-2-yl)-(4-phenylpiperazin-1-yl)methanone Traditional Name: (1-methyl-5-piperidinosulfonyl-indol-2-yl)-(4-phenylpiperazino)methanone Formula: C25H30N4O3S MolecularWeight: 466.5957

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)C=C1C(=O)N4CCN(CC4)C5=CC=CC=C5

Isomeric SMILES

CN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)C=C1C(=O)N4CCN(CC4)C5=CC=CC=C5

InChI

InChI=1S/C25H30N4O3S/c1-26-23-11-10-22(33(31,32)29-12-6-3-7-13-29)18-20(23)19-24(26)25(30)28-16-14-27(15-17-28)21-8-4-2-5-9-21/h2,4-5,8-11,18-19H,3,6-7,12-17H2,1H3