2-[2-[(3-chloranyl-4-methoxy-phenyl)-methylsulfonyl-amino]propanoylamino]-N-(pyridin-3-ylmethyl)benzamide

Systemtic Name: 2-[2-[(3-chloranyl-4-methoxy-phenyl)-methylsulfonyl-amino]propanoylamino]-N-(pyridin-3-ylmethyl)benzamide Openeye Name: 2-[2-(3-chloro-4-methoxy-N-methylsulfonyl-anilino)propanoylamino]-N-(3-pyridylmethyl)benzamide CAS Name: 2-[[2-(3-chloro-4-methoxy-N-methylsulfonylanilino)-1-oxopropyl]amino]-N-(3-pyridinylmethyl)benzamide IUPAC Name: 2-[2-(3-chloro-4-methoxy-N-methylsulfonylanilino)propanoylamino]-N-(pyridin-3-ylmethyl)benzamide Traditional Name: 2-[2-(3-chloro-N-mesyl-4-methoxy-anilino)propanoylamino]-N-(3-pyridylmethyl)benzamide Formula: C24H25ClN4O5S MolecularWeight: 516.9971

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1C(=O)NCC2=CN=CC=C2)N(C3=CC(=C(C=C3)OC)Cl)S(=O)(=O)C

Isomeric SMILES

CC(C(=O)NC1=CC=CC=C1C(=O)NCC2=CN=CC=C2)N(C3=CC(=C(C=C3)OC)Cl)S(=O)(=O)C

InChI

InChI=1S/C24H25ClN4O5S/c1-16(29(35(3,32)33)18-10-11-22(34-2)20(25)13-18)23(30)28-21-9-5-4-8-19(21)24(31)27-15-17-7-6-12-26-14-17/h4-14,16H,15H2,1-3H3,(H,27,31)(H,28,30)