1-[4-(phenylmethyl)piperazin-1-yl]-3-[(1-propanoyl-2,3-dihydroindol-5-yl)sulfonyl]propan-1-one

Systemtic Name: 1-[4-(phenylmethyl)piperazin-1-yl]-3-[(1-propanoyl-2,3-dihydroindol-5-yl)sulfonyl]propan-1-one Openeye Name: 1-(4-benzylpiperazin-1-yl)-3-(1-propanoylindolin-5-yl)sulfonyl-propan-1-one CAS Name: 3-[[1-(1-oxopropyl)-2,3-dihydroindol-5-yl]sulfonyl]-1-[4-(phenylmethyl)-1-piperazinyl]-1-propanone IUPAC Name: 1-(4-benzylpiperazin-1-yl)-3-[(1-propanoyl-2,3-dihydroindol-5-yl)sulfonyl]propan-1-one Traditional Name: 1-(4-benzylpiperazino)-3-(1-propionylindolin-5-yl)sulfonyl-propan-1-one Formula: C25H31N3O4S MolecularWeight: 469.59634

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1CCC2=C1C=CC(=C2)S(=O)(=O)CCC(=O)N3CCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

CCC(=O)N1CCC2=C1C=CC(=C2)S(=O)(=O)CCC(=O)N3CCN(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C25H31N3O4S/c1-2-24(29)28-12-10-21-18-22(8-9-23(21)28)33(31,32)17-11-25(30)27-15-13-26(14-16-27)19-20-6-4-3-5-7-20/h3-9,18H,2,10-17,19H2,1H3