[4-(2,3-dihydroindol-1-ylmethyl)phenyl]-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methanone

Systemtic Name: [4-(2,3-dihydroindol-1-ylmethyl)phenyl]-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methanone Openeye Name: [4-(indolin-1-ylmethyl)phenyl]-[4-(p-tolylsulfonyl)piperazin-1-yl]methanone CAS Name: [4-(2,3-dihydroindol-1-ylmethyl)phenyl]-[4-(4-methylphenyl)sulfonyl-1-piperazinyl]methanone IUPAC Name: [4-(2,3-dihydroindol-1-ylmethyl)phenyl]-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methanone Traditional Name: [4-(indolin-1-ylmethyl)phenyl]-(4-tosylpiperazino)methanone Formula: C27H29N3O3S MolecularWeight: 475.60246

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC=C(C=C3)CN4CCC5=CC=CC=C54

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC=C(C=C3)CN4CCC5=CC=CC=C54

InChI

InChI=1S/C27H29N3O3S/c1-21-6-12-25(13-7-21)34(32,33)30-18-16-28(17-19-30)27(31)24-10-8-22(9-11-24)20-29-15-14-23-4-2-3-5-26(23)29/h2-13H,14-20H2,1H3