2-[(3-chloranyl-4-methoxy-phenyl)sulfonyl-(phenylmethyl)amino]-N-(pyridin-4-ylmethyl)ethanamide

Systemtic Name: 2-[(3-chloranyl-4-methoxy-phenyl)sulfonyl-(phenylmethyl)amino]-N-(pyridin-4-ylmethyl)ethanamide Openeye Name: 2-[benzyl-(3-chloro-4-methoxy-phenyl)sulfonyl-amino]-N-(4-pyridylmethyl)acetamide CAS Name: 2-[(3-chloro-4-methoxyphenyl)sulfonyl-(phenylmethyl)amino]-N-(pyridin-4-ylmethyl)acetamide IUPAC Name: 2-[benzyl-(3-chloro-4-methoxyphenyl)sulfonylamino]-N-(pyridin-4-ylmethyl)acetamide Traditional Name: 2-[benzyl-(3-chloro-4-methoxy-phenyl)sulfonyl-amino]-N-(4-pyridylmethyl)acetamide Formula: C22H22ClN3O4S MolecularWeight: 459.94578

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N(CC2=CC=CC=C2)CC(=O)NCC3=CC=NC=C3)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N(CC2=CC=CC=C2)CC(=O)NCC3=CC=NC=C3)Cl

InChI

InChI=1S/C22H22ClN3O4S/c1-30-21-8-7-19(13-20(21)23)31(28,29)26(15-18-5-3-2-4-6-18)16-22(27)25-14-17-9-11-24-12-10-17/h2-13H,14-16H2,1H3,(H,25,27)