2-[[4-(3-azanyl-3-oxidanylidene-propyl)-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]propanamide

Systemtic Name: 2-[[4-(3-azanyl-3-oxidanylidene-propyl)-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]propanamide Openeye Name: 2-[[4-(3-amino-3-oxo-propyl)-5-(2-furyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide CAS Name: 2-[[4-(3-amino-3-oxopropyl)-5-(2-furanyl)-1,2,4-triazol-3-yl]thio]propanamide IUPAC Name: 2-[[4-(3-amino-3-oxopropyl)-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]propanamide Traditional Name: 2-[[4-(3-amino-3-keto-propyl)-5-(2-furyl)-1,2,4-triazol-3-yl]thio]propionamide Formula: C12H15N5O3S MolecularWeight: 309.3442

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N)SC1=NN=C(N1CCC(=O)N)C2=CC=CO2

Isomeric SMILES

CC(C(=O)N)SC1=NN=C(N1CCC(=O)N)C2=CC=CO2

InChI

InChI=1S/C12H15N5O3S/c1-7(10(14)19)21-12-16-15-11(8-3-2-6-20-8)17(12)5-4-9(13)18/h2-3,6-7H,4-5H2,1H3,(H2,13,18)(H2,14,19)