N-carbamothioylimino-1-(3-chlorophenyl)-4-methoxy-5-(2-phenylhydrazinyl)pyrazole-3-carboxamide

Systemtic Name: N-carbamothioylimino-1-(3-chlorophenyl)-4-methoxy-5-(2-phenylhydrazinyl)pyrazole-3-carboxamide Openeye Name: N-carbamothioylimino-1-(3-chlorophenyl)-4-methoxy-5-(2-phenylhydrazino)pyrazole-3-carboxamide CAS Name: N-carbamothioylimino-1-(3-chlorophenyl)-4-methoxy-5-(phenylhydrazo)-3-pyrazolecarboxamide IUPAC Name: N-carbamothioylimino-1-(3-chlorophenyl)-4-methoxy-5-(2-phenylhydrazinyl)pyrazole-3-carboxamide Traditional Name: 1-(3-chlorophenyl)-4-methoxy-5-(N'-phenylhydrazino)-N-thiocarbamoylimino-pyrazole-3-carboxamide Formula: C18H16ClN7O2S MolecularWeight: 429.88334

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(N(N=C1C(=O)N=NC(=S)N)C2=CC(=CC=C2)Cl)NNC3=CC=CC=C3

Isomeric SMILES

COC1=C(N(N=C1C(=O)N=NC(=S)N)C2=CC(=CC=C2)Cl)NNC3=CC=CC=C3

InChI

InChI=1S/C18H16ClN7O2S/c1-28-15-14(17(27)23-24-18(20)29)25-26(13-9-5-6-11(19)10-13)16(15)22-21-12-7-3-2-4-8-12/h2-10,21-22H,1H3,(H2,20,29)