N-[1-(1,3-benzodioxol-5-yl)ethyl]-3,5-dimethyl-1-phenyl-pyrazole-4-sulfonamide

Systemtic Name: N-[1-(1,3-benzodioxol-5-yl)ethyl]-3,5-dimethyl-1-phenyl-pyrazole-4-sulfonamide Openeye Name: N-[1-(1,3-benzodioxol-5-yl)ethyl]-3,5-dimethyl-1-phenyl-pyrazole-4-sulfonamide CAS Name: N-[1-(1,3-benzodioxol-5-yl)ethyl]-3,5-dimethyl-1-phenyl-4-pyrazolesulfonamide IUPAC Name: N-[1-(1,3-benzodioxol-5-yl)ethyl]-3,5-dimethyl-1-phenylpyrazole-4-sulfonamide Traditional Name: N-[1-(1,3-benzodioxol-5-yl)ethyl]-3,5-dimethyl-1-phenyl-pyrazole-4-sulfonamide Formula: C20H21N3O4S MolecularWeight: 399.46344

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)S(=O)(=O)NC(C)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)S(=O)(=O)NC(C)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C20H21N3O4S/c1-13(16-9-10-18-19(11-16)27-12-26-18)22-28(24,25)20-14(2)21-23(15(20)3)17-7-5-4-6-8-17/h4-11,13,22H,12H2,1-3H3