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

Systemtic Name: N-(4-tert-butylphenyl)-4-chloranyl-3-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-(4-tert-butylphenyl)-4-chloro-3-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-(4-tert-butylphenyl)-4-chloro-3-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-(4-tert-butylphenyl)-4-chloro-3-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-(4-tert-butylphenyl)-4-chloro-3-pyrrolidinosulfonyl-benzamide Formula: C21H25ClN2O3S MolecularWeight: 420.9528

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H25ClN2O3S/c1-21(2,3)16-7-9-17(10-8-16)23-20(25)15-6-11-18(22)19(14-15)28(26,27)24-12-4-5-13-24/h6-11,14H,4-5,12-13H2,1-3H3,(H,23,25)