N-[4-(pyridin-4-ylmethylcarbamothioylamino)phenyl]-1,2,3-thiadiazole-4-carboxamide

Systemtic Name: N-[4-(pyridin-4-ylmethylcarbamothioylamino)phenyl]-1,2,3-thiadiazole-4-carboxamide Openeye Name: N-[4-(4-pyridylmethylcarbamothioylamino)phenyl]thiadiazole-4-carboxamide CAS Name: N-[4-[[(pyridin-4-ylmethylamino)-sulfanylidenemethyl]amino]phenyl]-4-thiadiazolecarboxamide IUPAC Name: N-[4-(pyridin-4-ylmethylcarbamothioylamino)phenyl]thiadiazole-4-carboxamide Traditional Name: N-[4-(4-pyridylmethylthiocarbamoylamino)phenyl]thiadiazole-4-carboxamide Formula: C16H14N6OS2 MolecularWeight: 370.45196

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC(=O)C2=CSN=N2)NC(=S)NCC3=CC=NC=C3

Isomeric SMILES

C1=CC(=CC=C1NC(=O)C2=CSN=N2)NC(=S)NCC3=CC=NC=C3

InChI

InChI=1S/C16H14N6OS2/c23-15(14-10-25-22-21-14)19-12-1-3-13(4-2-12)20-16(24)18-9-11-5-7-17-8-6-11/h1-8,10H,9H2,(H,19,23)(H2,18,20,24)