3-pyrrolidin-1-ylsulfonyl-N-[(E)-(2,4,6-trimethylphenyl)methylideneamino]benzamide

Systemtic Name: 3-pyrrolidin-1-ylsulfonyl-N-[(E)-(2,4,6-trimethylphenyl)methylideneamino]benzamide Openeye Name: 3-pyrrolidin-1-ylsulfonyl-N-[(E)-(2,4,6-trimethylphenyl)methyleneamino]benzamide CAS Name: 3-(1-pyrrolidinylsulfonyl)-N-[(E)-(2,4,6-trimethylphenyl)methylideneamino]benzamide IUPAC Name: 3-pyrrolidin-1-ylsulfonyl-N-[(E)-(2,4,6-trimethylphenyl)methylideneamino]benzamide Traditional Name: 3-pyrrolidinosulfonyl-N-[(E)-(2,4,6-trimethylbenzylidene)amino]benzamide Formula: C21H25N3O3S MolecularWeight: 399.5065

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)C=NNC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCCC3)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)/C=N/NC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCCC3)C

InChI

InChI=1S/C21H25N3O3S/c1-15-11-16(2)20(17(3)12-15)14-22-23-21(25)18-7-6-8-19(13-18)28(26,27)24-9-4-5-10-24/h6-8,11-14H,4-5,9-10H2,1-3H3,(H,23,25)/b22-14+