3-(2,6-diethylphenyl)sulfonyl-N,N-diethyl-4-prop-2-enyl-pyrazole-1-carboxamide

Systemtic Name: 3-(2,6-diethylphenyl)sulfonyl-N,N-diethyl-4-prop-2-enyl-pyrazole-1-carboxamide Openeye Name: 4-allyl-3-(2,6-diethylphenyl)sulfonyl-N,N-diethyl-pyrazole-1-carboxamide CAS Name: 3-(2,6-diethylphenyl)sulfonyl-N,N-diethyl-4-prop-2-enyl-1-pyrazolecarboxamide IUPAC Name: 3-(2,6-diethylphenyl)sulfonyl-N,N-diethyl-4-prop-2-enylpyrazole-1-carboxamide Traditional Name: 4-allyl-3-(2,6-diethylphenyl)sulfonyl-N,N-diethyl-pyrazole-1-carboxamide Formula: C21H29N3O3S MolecularWeight: 403.53826

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)CC)S(=O)(=O)C2=NN(C=C2CC=C)C(=O)N(CC)CC

Isomeric SMILES

CCC1=C(C(=CC=C1)CC)S(=O)(=O)C2=NN(C=C2CC=C)C(=O)N(CC)CC

InChI

InChI=1S/C21H29N3O3S/c1-6-12-18-15-24(21(25)23(9-4)10-5)22-20(18)28(26,27)19-16(7-2)13-11-14-17(19)8-3/h6,11,13-15H,1,7-10,12H2,2-5H3