5-azanyl-N-(4-chlorophenyl)-3-morpholin-4-yl-1,2,4-triazole-1-carbothioamide

Systemtic Name: 5-azanyl-N-(4-chlorophenyl)-3-morpholin-4-yl-1,2,4-triazole-1-carbothioamide Openeye Name: 5-amino-N-(4-chlorophenyl)-3-morpholino-1,2,4-triazole-1-carbothioamide CAS Name: 5-amino-N-(4-chlorophenyl)-3-(4-morpholinyl)-1,2,4-triazole-1-carbothioamide IUPAC Name: 5-amino-N-(4-chlorophenyl)-3-morpholin-4-yl-1,2,4-triazole-1-carbothioamide Traditional Name: 5-amino-N-(4-chlorophenyl)-3-morpholino-1,2,4-triazole-1-carbothioamide Formula: C13H15ClN6OS MolecularWeight: 338.8158

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=NN(C(=N2)N)C(=S)NC3=CC=C(C=C3)Cl

Isomeric SMILES

C1COCCN1C2=NN(C(=N2)N)C(=S)NC3=CC=C(C=C3)Cl

InChI

InChI=1S/C13H15ClN6OS/c14-9-1-3-10(4-2-9)16-13(22)20-11(15)17-12(18-20)19-5-7-21-8-6-19/h1-4H,5-8H2,(H,16,22)(H2,15,17,18)