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

Systemtic Name: N-[1-(4-tert-butylphenyl)ethyl]-4-chloranyl-3-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-[1-(4-tert-butylphenyl)ethyl]-4-chloro-3-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-[1-(4-tert-butylphenyl)ethyl]-4-chloro-3-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-[1-(4-tert-butylphenyl)ethyl]-4-chloro-3-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-[1-(4-tert-butylphenyl)ethyl]-4-chloro-3-pyrrolidinosulfonyl-benzamide Formula: C23H29ClN2O3S MolecularWeight: 449.00596

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H29ClN2O3S/c1-16(17-7-10-19(11-8-17)23(2,3)4)25-22(27)18-9-12-20(24)21(15-18)30(28,29)26-13-5-6-14-26/h7-12,15-16H,5-6,13-14H2,1-4H3,(H,25,27)