(3Z)-3-(phenylmethylidene)-5-(phenylsulfonyl)-2,6-bis(propan-2-ylsulfonyl)-1H-isoindole

Systemtic Name: (3Z)-3-(phenylmethylidene)-5-(phenylsulfonyl)-2,6-bis(propan-2-ylsulfonyl)-1H-isoindole Openeye Name: (1Z)-6-(benzenesulfonyl)-1-benzylidene-2,5-bis(isopropylsulfonyl)isoindoline CAS Name: (3Z)-5-(benzenesulfonyl)-3-(phenylmethylene)-2,6-bis(propan-2-ylsulfonyl)-1H-isoindole IUPAC Name: (3Z)-5-(benzenesulfonyl)-3-benzylidene-2,6-bis(propan-2-ylsulfonyl)-1H-isoindole Traditional Name: (1Z)-1-benzal-6-besyl-2,5-bis(isopropylsulfonyl)isoindoline Formula: C27H29NO6S3 MolecularWeight: 559.71726

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)C1=C(C=C2C(=C1)CN(C2=CC3=CC=CC=C3)S(=O)(=O)C(C)C)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CC(C)S(=O)(=O)C1=C(C=C\2C(=C1)CN(/C2=C\C3=CC=CC=C3)S(=O)(=O)C(C)C)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C27H29NO6S3/c1-19(2)35(29,30)26-16-22-18-28(37(33,34)20(3)4)25(15-21-11-7-5-8-12-21)24(22)17-27(26)36(31,32)23-13-9-6-10-14-23/h5-17,19-20H,18H2,1-4H3/b25-15-