N-[(E)-(4-tert-butylphenyl)methylideneamino]-3-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[(E)-(4-tert-butylphenyl)methylideneamino]-3-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-[(E)-(4-tert-butylphenyl)methyleneamino]-3-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-[(E)-(4-tert-butylphenyl)methylideneamino]-3-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-[(E)-(4-tert-butylphenyl)methylideneamino]-3-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-[(E)-(4-tert-butylbenzylidene)amino]-3-pyrrolidinosulfonyl-benzamide Formula: C22H27N3O3S MolecularWeight: 413.53308

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H27N3O3S/c1-22(2,3)19-11-9-17(10-12-19)16-23-24-21(26)18-7-6-8-20(15-18)29(27,28)25-13-4-5-14-25/h6-12,15-16H,4-5,13-14H2,1-3H3,(H,24,26)/b23-16+