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

Systemtic Name: 2-[(3-chloranyl-4-methoxy-phenyl)sulfonyl-cyclohexyl-amino]-N-(pyridin-3-ylmethyl)ethanamide Openeye Name: 2-[(3-chloro-4-methoxy-phenyl)sulfonyl-cyclohexyl-amino]-N-(3-pyridylmethyl)acetamide CAS Name: 2-[(3-chloro-4-methoxyphenyl)sulfonyl-cyclohexylamino]-N-(3-pyridinylmethyl)acetamide IUPAC Name: 2-[(3-chloro-4-methoxyphenyl)sulfonyl-cyclohexylamino]-N-(pyridin-3-ylmethyl)acetamide Traditional Name: 2-[(3-chloro-4-methoxy-phenyl)sulfonyl-cyclohexyl-amino]-N-(3-pyridylmethyl)acetamide Formula: C21H26ClN3O4S MolecularWeight: 451.96684

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N(CC(=O)NCC2=CN=CC=C2)C3CCCCC3)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N(CC(=O)NCC2=CN=CC=C2)C3CCCCC3)Cl

InChI

InChI=1S/C21H26ClN3O4S/c1-29-20-10-9-18(12-19(20)22)30(27,28)25(17-7-3-2-4-8-17)15-21(26)24-14-16-6-5-11-23-13-16/h5-6,9-13,17H,2-4,7-8,14-15H2,1H3,(H,24,26)