N-(3-chloranyl-2,6-diethyl-phenyl)-4-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: N-(3-chloranyl-2,6-diethyl-phenyl)-4-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-(3-chloro-2,6-diethyl-phenyl)-4-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-(3-chloro-2,6-diethylphenyl)-4-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-(3-chloro-2,6-diethylphenyl)-4-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-(3-chloro-2,6-diethyl-phenyl)-4-pyrrolidinosulfonyl-benzamide Formula: C21H25ClN2O3S MolecularWeight: 420.9528

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C(C=C1)Cl)CC)NC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCC3

Isomeric SMILES

CCC1=C(C(=C(C=C1)Cl)CC)NC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C21H25ClN2O3S/c1-3-15-9-12-19(22)18(4-2)20(15)23-21(25)16-7-10-17(11-8-16)28(26,27)24-13-5-6-14-24/h7-12H,3-6,13-14H2,1-2H3,(H,23,25)