(2R)-2-[(5-chloranyl-2-methoxy-phenyl)-methylsulfonyl-amino]-N-(pyridin-3-ylmethyl)propanamide

Systemtic Name: (2R)-2-[(5-chloranyl-2-methoxy-phenyl)-methylsulfonyl-amino]-N-(pyridin-3-ylmethyl)propanamide Openeye Name: (2R)-2-(5-chloro-2-methoxy-N-methylsulfonyl-anilino)-N-(3-pyridylmethyl)propanamide CAS Name: (2R)-2-(5-chloro-2-methoxy-N-methylsulfonylanilino)-N-(3-pyridinylmethyl)propanamide IUPAC Name: (2R)-2-(5-chloro-2-methoxy-N-methylsulfonylanilino)-N-(pyridin-3-ylmethyl)propanamide Traditional Name: (2R)-2-(5-chloro-N-mesyl-2-methoxy-anilino)-N-(3-pyridylmethyl)propionamide Formula: C17H20ClN3O4S MolecularWeight: 397.8764

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CN=CC=C1)N(C2=C(C=CC(=C2)Cl)OC)S(=O)(=O)C

Isomeric SMILES

C[C@H](C(=O)NCC1=CN=CC=C1)N(C2=C(C=CC(=C2)Cl)OC)S(=O)(=O)C

InChI

InChI=1S/C17H20ClN3O4S/c1-12(17(22)20-11-13-5-4-8-19-10-13)21(26(3,23)24)15-9-14(18)6-7-16(15)25-2/h4-10,12H,11H2,1-3H3,(H,20,22)/t12-/m1/s1