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

Systemtic Name: N-aminocarbonyl-2-[(1-phenyl-1,2,4-triazol-3-yl)sulfanyl]propanamide Openeye Name: N-carbamoyl-2-[(1-phenyl-1,2,4-triazol-3-yl)sulfanyl]propanamide CAS Name: N-carbamoyl-2-[(1-phenyl-1,2,4-triazol-3-yl)thio]propanamide IUPAC Name: N-carbamoyl-2-[(1-phenyl-1,2,4-triazol-3-yl)sulfanyl]propanamide Traditional Name: N-carbamoyl-2-[(1-phenyl-1,2,4-triazol-3-yl)thio]propionamide Formula: C12H13N5O2S MolecularWeight: 291.32892

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(=O)N)SC1=NN(C=N1)C2=CC=CC=C2

Isomeric SMILES

CC(C(=O)NC(=O)N)SC1=NN(C=N1)C2=CC=CC=C2

InChI

InChI=1S/C12H13N5O2S/c1-8(10(18)15-11(13)19)20-12-14-7-17(16-12)9-5-3-2-4-6-9/h2-8H,1H3,(H3,13,15,18,19)