3-(carbamothioylamino)-5-phenyl-1H-pyrazole-4-carbothioamide

Systemtic Name: 3-(carbamothioylamino)-5-phenyl-1H-pyrazole-4-carbothioamide Openeye Name: 3-(carbamothioylamino)-5-phenyl-1H-pyrazole-4-carbothioamide CAS Name: 3-(carbamothioylamino)-5-phenyl-1H-pyrazole-4-carbothioamide IUPAC Name: 3-(carbamothioylamino)-5-phenyl-1H-pyrazole-4-carbothioamide Traditional Name: 5-phenyl-3-thioureido-1H-pyrazole-4-carbothioamide Formula: C11H11N5S2 MolecularWeight: 277.36854

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(C(=NN2)NC(=S)N)C(=S)N

Isomeric SMILES

C1=CC=C(C=C1)C2=C(C(=NN2)NC(=S)N)C(=S)N

InChI

InChI=1S/C11H11N5S2/c12-9(17)7-8(6-4-2-1-3-5-6)15-16-10(7)14-11(13)18/h1-5H,(H2,12,17)(H4,13,14,15,16,18)