5-(5-chloranylthiophen-2-yl)-N-[(E)-(4-methylphenyl)methylideneamino]-1H-pyrazole-3-carboxamide

Systemtic Name: 5-(5-chloranylthiophen-2-yl)-N-[(E)-(4-methylphenyl)methylideneamino]-1H-pyrazole-3-carboxamide Openeye Name: 5-(5-chloro-2-thienyl)-N-[(E)-p-tolylmethyleneamino]-1H-pyrazole-3-carboxamide CAS Name: 5-(5-chloro-2-thiophenyl)-N-[(E)-(4-methylphenyl)methylideneamino]-1H-pyrazole-3-carboxamide IUPAC Name: 5-(5-chlorothiophen-2-yl)-N-[(E)-(4-methylphenyl)methylideneamino]-1H-pyrazole-3-carboxamide Traditional Name: 5-(5-chloro-2-thienyl)-N-[(E)-(4-methylbenzylidene)amino]-1H-pyrazole-3-carboxamide Formula: C16H13ClN4OS MolecularWeight: 344.81862

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C=NNC(=O)C2=NNC(=C2)C3=CC=C(S3)Cl

Isomeric SMILES

CC1=CC=C(C=C1)/C=N/NC(=O)C2=NNC(=C2)C3=CC=C(S3)Cl

InChI

InChI=1S/C16H13ClN4OS/c1-10-2-4-11(5-3-10)9-18-21-16(22)13-8-12(19-20-13)14-6-7-15(17)23-14/h2-9H,1H3,(H,19,20)(H,21,22)/b18-9+