N-(4-tert-butylphenyl)-3-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: N-(4-tert-butylphenyl)-3-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-(4-tert-butylphenyl)-3-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-(4-tert-butylphenyl)-3-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-(4-tert-butylphenyl)-3-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-(4-tert-butylphenyl)-3-pyrrolidinosulfonyl-benzamide Formula: C21H26N2O3S MolecularWeight: 386.50774

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H26N2O3S/c1-21(2,3)17-9-11-18(12-10-17)22-20(24)16-7-6-8-19(15-16)27(25,26)23-13-4-5-14-23/h6-12,15H,4-5,13-14H2,1-3H3,(H,22,24)