5-chloranyl-3-methyl-1-phenyl-N'-(4,5,6,7-tetrahydro-1-benzothiophen-2-ylcarbonyl)pyrazole-4-carbohydrazide

Systemtic Name: 5-chloranyl-3-methyl-1-phenyl-N'-(4,5,6,7-tetrahydro-1-benzothiophen-2-ylcarbonyl)pyrazole-4-carbohydrazide Openeye Name: 5-chloro-3-methyl-1-phenyl-N'-(4,5,6,7-tetrahydrobenzothiophene-2-carbonyl)pyrazole-4-carbohydrazide CAS Name: 5-chloro-3-methyl-N'-[oxo(4,5,6,7-tetrahydro-1-benzothiophen-2-yl)methyl]-1-phenyl-4-pyrazolecarbohydrazide IUPAC Name: 5-chloro-3-methyl-1-phenyl-N'-(4,5,6,7-tetrahydro-1-benzothiophene-2-carbonyl)pyrazole-4-carbohydrazide Traditional Name: 5-chloro-3-methyl-1-phenyl-N'-(4,5,6,7-tetrahydrobenzothiophene-2-carbonyl)pyrazole-4-carbohydrazide Formula: C20H19ClN4O2S MolecularWeight: 414.90846

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)NNC(=O)C2=CC3=C(S2)CCCC3)Cl)C4=CC=CC=C4

Isomeric SMILES

CC1=NN(C(=C1C(=O)NNC(=O)C2=CC3=C(S2)CCCC3)Cl)C4=CC=CC=C4

InChI

InChI=1S/C20H19ClN4O2S/c1-12-17(18(21)25(24-12)14-8-3-2-4-9-14)20(27)23-22-19(26)16-11-13-7-5-6-10-15(13)28-16/h2-4,8-9,11H,5-7,10H2,1H3,(H,22,26)(H,23,27)