N-aminocarbonyl-2-[[4-(3-chlorophenyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide

Systemtic Name: N-aminocarbonyl-2-[[4-(3-chlorophenyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide Openeye Name: N-carbamoyl-2-[[4-(3-chlorophenyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide CAS Name: N-carbamoyl-2-[[4-(3-chlorophenyl)-1,2,4-triazol-3-yl]thio]propanamide IUPAC Name: N-carbamoyl-2-[[4-(3-chlorophenyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide Traditional Name: N-carbamoyl-2-[[4-(3-chlorophenyl)-1,2,4-triazol-3-yl]thio]propionamide Formula: C12H12ClN5O2S MolecularWeight: 325.77398

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(=O)N)SC1=NN=CN1C2=CC(=CC=C2)Cl

Isomeric SMILES

CC(C(=O)NC(=O)N)SC1=NN=CN1C2=CC(=CC=C2)Cl

InChI

InChI=1S/C12H12ClN5O2S/c1-7(10(19)16-11(14)20)21-12-17-15-6-18(12)9-4-2-3-8(13)5-9/h2-7H,1H3,(H3,14,16,19,20)