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

Systemtic Name: 2-[[4-(3-azanyl-3-oxidanylidene-propyl)-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-methyl-N-phenyl-propanamide Openeye Name: 2-[[4-(3-amino-3-oxo-propyl)-5-(2-furyl)-1,2,4-triazol-3-yl]sulfanyl]-N-methyl-N-phenyl-propanamide CAS Name: 2-[[4-(3-amino-3-oxopropyl)-5-(2-furanyl)-1,2,4-triazol-3-yl]thio]-N-methyl-N-phenylpropanamide IUPAC Name: 2-[[4-(3-amino-3-oxopropyl)-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-methyl-N-phenylpropanamide Traditional Name: 2-[[4-(3-amino-3-keto-propyl)-5-(2-furyl)-1,2,4-triazol-3-yl]thio]-N-methyl-N-phenyl-propionamide Formula: C19H21N5O3S MolecularWeight: 399.46674

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N(C)C1=CC=CC=C1)SC2=NN=C(N2CCC(=O)N)C3=CC=CO3

Isomeric SMILES

CC(C(=O)N(C)C1=CC=CC=C1)SC2=NN=C(N2CCC(=O)N)C3=CC=CO3

InChI

InChI=1S/C19H21N5O3S/c1-13(18(26)23(2)14-7-4-3-5-8-14)28-19-22-21-17(15-9-6-12-27-15)24(19)11-10-16(20)25/h3-9,12-13H,10-11H2,1-2H3,(H2,20,25)