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

Systemtic Name: 2-[(3-chloranyl-4-methoxy-phenyl)sulfonyl-cyclohexyl-amino]-N-(pyridin-4-ylmethyl)ethanamide Openeye Name: 2-[(3-chloro-4-methoxy-phenyl)sulfonyl-cyclohexyl-amino]-N-(4-pyridylmethyl)acetamide CAS Name: 2-[(3-chloro-4-methoxyphenyl)sulfonyl-cyclohexylamino]-N-(pyridin-4-ylmethyl)acetamide IUPAC Name: 2-[(3-chloro-4-methoxyphenyl)sulfonyl-cyclohexylamino]-N-(pyridin-4-ylmethyl)acetamide Traditional Name: 2-[(3-chloro-4-methoxy-phenyl)sulfonyl-cyclohexyl-amino]-N-(4-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=CC=NC=C2)C3CCCCC3)Cl

Isomeric SMILES

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

InChI

InChI=1S/C21H26ClN3O4S/c1-29-20-8-7-18(13-19(20)22)30(27,28)25(17-5-3-2-4-6-17)15-21(26)24-14-16-9-11-23-12-10-16/h7-13,17H,2-6,14-15H2,1H3,(H,24,26)