1-(2-methyl-2,3-dihydroindol-1-yl)-2-[4-(phenylmethyl)sulfonylpiperazin-1-yl]propan-1-one

Systemtic Name: 1-(2-methyl-2,3-dihydroindol-1-yl)-2-[4-(phenylmethyl)sulfonylpiperazin-1-yl]propan-1-one Openeye Name: 2-(4-benzylsulfonylpiperazin-1-yl)-1-(2-methylindolin-1-yl)propan-1-one CAS Name: 1-(2-methyl-2,3-dihydroindol-1-yl)-2-[4-(phenylmethyl)sulfonyl-1-piperazinyl]-1-propanone IUPAC Name: 2-(4-benzylsulfonylpiperazin-1-yl)-1-(2-methyl-2,3-dihydroindol-1-yl)propan-1-one Traditional Name: 2-(4-benzylsulfonylpiperazino)-1-(2-methylindolin-1-yl)propan-1-one Formula: C23H29N3O3S MolecularWeight: 427.55966

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=CC=CC=C2N1C(=O)C(C)N3CCN(CC3)S(=O)(=O)CC4=CC=CC=C4

Isomeric SMILES

CC1CC2=CC=CC=C2N1C(=O)C(C)N3CCN(CC3)S(=O)(=O)CC4=CC=CC=C4

InChI

InChI=1S/C23H29N3O3S/c1-18-16-21-10-6-7-11-22(21)26(18)23(27)19(2)24-12-14-25(15-13-24)30(28,29)17-20-8-4-3-5-9-20/h3-11,18-19H,12-17H2,1-2H3