4-[(5-chloranyl-2-methoxy-phenyl)sulfonylamino]-N-(pyridin-3-ylmethyl)butanamide

Systemtic Name: 4-[(5-chloranyl-2-methoxy-phenyl)sulfonylamino]-N-(pyridin-3-ylmethyl)butanamide Openeye Name: 4-[(5-chloro-2-methoxy-phenyl)sulfonylamino]-N-(3-pyridylmethyl)butanamide CAS Name: 4-[(5-chloro-2-methoxyphenyl)sulfonylamino]-N-(3-pyridinylmethyl)butanamide IUPAC Name: 4-[(5-chloro-2-methoxyphenyl)sulfonylamino]-N-(pyridin-3-ylmethyl)butanamide Traditional Name: 4-[(5-chloro-2-methoxy-phenyl)sulfonylamino]-N-(3-pyridylmethyl)butyramide Formula: C17H20ClN3O4S MolecularWeight: 397.8764

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)S(=O)(=O)NCCCC(=O)NCC2=CN=CC=C2

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)S(=O)(=O)NCCCC(=O)NCC2=CN=CC=C2

InChI

InChI=1S/C17H20ClN3O4S/c1-25-15-7-6-14(18)10-16(15)26(23,24)21-9-3-5-17(22)20-12-13-4-2-8-19-11-13/h2,4,6-8,10-11,21H,3,5,9,12H2,1H3,(H,20,22)