4-ethyl-N-[2-(3-pyrrolidin-1-ylsulfonylphenyl)-3H-isoindol-1-ylidene]benzamide

Systemtic Name: 4-ethyl-N-[2-(3-pyrrolidin-1-ylsulfonylphenyl)-3H-isoindol-1-ylidene]benzamide Openeye Name: 4-ethyl-N-[2-(3-pyrrolidin-1-ylsulfonylphenyl)isoindolin-1-ylidene]benzamide CAS Name: 4-ethyl-N-[2-[3-(1-pyrrolidinylsulfonyl)phenyl]-3H-isoindol-1-ylidene]benzamide IUPAC Name: 4-ethyl-N-[2-(3-pyrrolidin-1-ylsulfonylphenyl)-3H-isoindol-1-ylidene]benzamide Traditional Name: 4-ethyl-N-[2-(3-pyrrolidinosulfonylphenyl)isoindolin-1-ylidene]benzamide Formula: C27H27N3O3S MolecularWeight: 473.58658

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)N=C2C3=CC=CC=C3CN2C4=CC(=CC=C4)S(=O)(=O)N5CCCC5

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)N=C2C3=CC=CC=C3CN2C4=CC(=CC=C4)S(=O)(=O)N5CCCC5

InChI

InChI=1S/C27H27N3O3S/c1-2-20-12-14-21(15-13-20)27(31)28-26-25-11-4-3-8-22(25)19-30(26)23-9-7-10-24(18-23)34(32,33)29-16-5-6-17-29/h3-4,7-15,18H,2,5-6,16-17,19H2,1H3