4-but-3-enyl-N,5-bis(4-chlorophenyl)-4-methyl-3H-pyrazole-2-carboxamide

Systemtic Name: 4-but-3-enyl-N,5-bis(4-chlorophenyl)-4-methyl-3H-pyrazole-2-carboxamide Openeye Name: 4-but-3-enyl-N,5-bis(4-chlorophenyl)-4-methyl-3H-pyrazole-2-carboxamide CAS Name: 4-but-3-enyl-N,5-bis(4-chlorophenyl)-4-methyl-3H-pyrazole-2-carboxamide IUPAC Name: 4-but-3-enyl-N,5-bis(4-chlorophenyl)-4-methyl-3H-pyrazole-2-carboxamide Traditional Name: 4-but-3-enyl-N,3-bis(4-chlorophenyl)-4-methyl-2-pyrazoline-1-carboxamide Formula: C21H21Cl2N3O MolecularWeight: 402.31694

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CN(N=C1C2=CC=C(C=C2)Cl)C(=O)NC3=CC=C(C=C3)Cl)CCC=C

Isomeric SMILES

CC1(CN(N=C1C2=CC=C(C=C2)Cl)C(=O)NC3=CC=C(C=C3)Cl)CCC=C

InChI

InChI=1S/C21H21Cl2N3O/c1-3-4-13-21(2)14-26(20(27)24-18-11-9-17(23)10-12-18)25-19(21)15-5-7-16(22)8-6-15/h3,5-12H,1,4,13-14H2,2H3,(H,24,27)