N-(4-bromanyl-2-methyl-phenyl)-1-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]piperidine-3-carboxamide

Systemtic Name: N-(4-bromanyl-2-methyl-phenyl)-1-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]piperidine-3-carboxamide Openeye Name: N-(4-bromo-2-methyl-phenyl)-1-(3,5-dimethylisoxazol-4-yl)sulfonyl-piperidine-3-carboxamide CAS Name: N-(4-bromo-2-methylphenyl)-1-[(3,5-dimethyl-4-isoxazolyl)sulfonyl]-3-piperidinecarboxamide IUPAC Name: N-(4-bromo-2-methylphenyl)-1-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]piperidine-3-carboxamide Traditional Name: N-(4-bromo-2-methyl-phenyl)-1-(3,5-dimethylisoxazol-4-yl)sulfonyl-nipecotamide Formula: C18H22BrN3O4S MolecularWeight: 456.35398

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)NC(=O)C2CCCN(C2)S(=O)(=O)C3=C(ON=C3C)C

Isomeric SMILES

CC1=C(C=CC(=C1)Br)NC(=O)C2CCCN(C2)S(=O)(=O)C3=C(ON=C3C)C

InChI

InChI=1S/C18H22BrN3O4S/c1-11-9-15(19)6-7-16(11)20-18(23)14-5-4-8-22(10-14)27(24,25)17-12(2)21-26-13(17)3/h6-7,9,14H,4-5,8,10H2,1-3H3,(H,20,23)