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

Systemtic Name: N-aminocarbonyl-2-[[5-(3-azanyl-3-oxidanylidene-propyl)-4-(furan-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide Openeye Name: 2-[[5-(3-amino-3-oxo-propyl)-4-(2-furylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-carbamoyl-propanamide CAS Name: 2-[[5-(3-amino-3-oxopropyl)-4-(2-furanylmethyl)-1,2,4-triazol-3-yl]thio]-N-carbamoylpropanamide IUPAC Name: 2-[[5-(3-amino-3-oxopropyl)-4-(furan-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-carbamoylpropanamide Traditional Name: 2-[[5-(3-amino-3-keto-propyl)-4-(2-furfuryl)-1,2,4-triazol-3-yl]thio]-N-carbamoyl-propionamide Formula: C14H18N6O4S MolecularWeight: 366.39552

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(=O)N)SC1=NN=C(N1CC2=CC=CO2)CCC(=O)N

Isomeric SMILES

CC(C(=O)NC(=O)N)SC1=NN=C(N1CC2=CC=CO2)CCC(=O)N

InChI

InChI=1S/C14H18N6O4S/c1-8(12(22)17-13(16)23)25-14-19-18-11(5-4-10(15)21)20(14)7-9-3-2-6-24-9/h2-3,6,8H,4-5,7H2,1H3,(H2,15,21)(H3,16,17,22,23)