2-[(3-chlorophenyl)-methylsulfonyl-amino]-N-[4-(pyridin-4-ylmethyl)phenyl]ethanamide

Systemtic Name: 2-[(3-chlorophenyl)-methylsulfonyl-amino]-N-[4-(pyridin-4-ylmethyl)phenyl]ethanamide Openeye Name: 2-(3-chloro-N-methylsulfonyl-anilino)-N-[4-(4-pyridylmethyl)phenyl]acetamide CAS Name: 2-(3-chloro-N-methylsulfonylanilino)-N-[4-(pyridin-4-ylmethyl)phenyl]acetamide IUPAC Name: 2-(3-chloro-N-methylsulfonylanilino)-N-[4-(pyridin-4-ylmethyl)phenyl]acetamide Traditional Name: 2-(3-chloro-N-mesyl-anilino)-N-[4-(4-pyridylmethyl)phenyl]acetamide Formula: C21H20ClN3O3S MolecularWeight: 429.9198

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(CC(=O)NC1=CC=C(C=C1)CC2=CC=NC=C2)C3=CC(=CC=C3)Cl

Isomeric SMILES

CS(=O)(=O)N(CC(=O)NC1=CC=C(C=C1)CC2=CC=NC=C2)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C21H20ClN3O3S/c1-29(27,28)25(20-4-2-3-18(22)14-20)15-21(26)24-19-7-5-16(6-8-19)13-17-9-11-23-12-10-17/h2-12,14H,13,15H2,1H3,(H,24,26)