3,5-dimethyl-1-[(5-phenyl-1,2-oxazol-3-yl)methyl]-N,N-dipropyl-pyrazole-4-sulfonamide

Systemtic Name: 3,5-dimethyl-1-[(5-phenyl-1,2-oxazol-3-yl)methyl]-N,N-dipropyl-pyrazole-4-sulfonamide Openeye Name: 3,5-dimethyl-1-[(5-phenylisoxazol-3-yl)methyl]-N,N-dipropyl-pyrazole-4-sulfonamide CAS Name: 3,5-dimethyl-1-[(5-phenyl-3-isoxazolyl)methyl]-N,N-dipropyl-4-pyrazolesulfonamide IUPAC Name: 3,5-dimethyl-1-[(5-phenyl-1,2-oxazol-3-yl)methyl]-N,N-dipropylpyrazole-4-sulfonamide Traditional Name: 3,5-dimethyl-1-[(5-phenylisoxazol-3-yl)methyl]-N,N-dipropyl-pyrazole-4-sulfonamide Formula: C21H28N4O3S MolecularWeight: 416.53702

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC)S(=O)(=O)C1=C(N(N=C1C)CC2=NOC(=C2)C3=CC=CC=C3)C

Isomeric SMILES

CCCN(CCC)S(=O)(=O)C1=C(N(N=C1C)CC2=NOC(=C2)C3=CC=CC=C3)C

InChI

InChI=1S/C21H28N4O3S/c1-5-12-24(13-6-2)29(26,27)21-16(3)22-25(17(21)4)15-19-14-20(28-23-19)18-10-8-7-9-11-18/h7-11,14H,5-6,12-13,15H2,1-4H3