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

Systemtic Name: N-[4-(phenethylcarbamothioylamino)phenyl]-1,2,3-thiadiazole-4-carboxamide Openeye Name: N-[4-(phenethylcarbamothioylamino)phenyl]thiadiazole-4-carboxamide CAS Name: N-[4-[[(phenethylamino)-sulfanylidenemethyl]amino]phenyl]-4-thiadiazolecarboxamide IUPAC Name: N-[4-(phenethylcarbamothioylamino)phenyl]thiadiazole-4-carboxamide Traditional Name: N-[4-(phenethylthiocarbamoylamino)phenyl]thiadiazole-4-carboxamide Formula: C18H17N5OS2 MolecularWeight: 383.49048

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNC(=S)NC2=CC=C(C=C2)NC(=O)C3=CSN=N3

Isomeric SMILES

C1=CC=C(C=C1)CCNC(=S)NC2=CC=C(C=C2)NC(=O)C3=CSN=N3

InChI

InChI=1S/C18H17N5OS2/c24-17(16-12-26-23-22-16)20-14-6-8-15(9-7-14)21-18(25)19-11-10-13-4-2-1-3-5-13/h1-9,12H,10-11H2,(H,20,24)(H2,19,21,25)