2-chloranyl-N-[[4-(propan-2-ylcarbamoylamino)phenyl]methyl]-5-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: 2-chloranyl-N-[[4-(propan-2-ylcarbamoylamino)phenyl]methyl]-5-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: 2-chloro-N-[[4-(isopropylcarbamoylamino)phenyl]methyl]-5-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: 2-chloro-N-[[4-[[oxo-(propan-2-ylamino)methyl]amino]phenyl]methyl]-5-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: 2-chloro-N-[[4-(propan-2-ylcarbamoylamino)phenyl]methyl]-5-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: 2-chloro-N-[4-(isopropylcarbamoylamino)benzyl]-5-pyrrolidinosulfonyl-benzamide Formula: C22H27ClN4O4S MolecularWeight: 478.99218

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)NC1=CC=C(C=C1)CNC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCC3)Cl

Isomeric SMILES

CC(C)NC(=O)NC1=CC=C(C=C1)CNC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCC3)Cl

InChI

InChI=1S/C22H27ClN4O4S/c1-15(2)25-22(29)26-17-7-5-16(6-8-17)14-24-21(28)19-13-18(9-10-20(19)23)32(30,31)27-11-3-4-12-27/h5-10,13,15H,3-4,11-12,14H2,1-2H3,(H,24,28)(H2,25,26,29)