(2R)-2-[[4-azanyl-5-(phenylmethylsulfanyl)-1,2,4-triazol-3-yl]sulfanyl]-N-prop-2-enyl-propanamide

Systemtic Name: (2R)-2-[[4-azanyl-5-(phenylmethylsulfanyl)-1,2,4-triazol-3-yl]sulfanyl]-N-prop-2-enyl-propanamide Openeye Name: (2R)-N-allyl-2-[(4-amino-5-benzylsulfanyl-1,2,4-triazol-3-yl)sulfanyl]propanamide CAS Name: (2R)-2-[[4-amino-5-(phenylmethylthio)-1,2,4-triazol-3-yl]thio]-N-prop-2-enylpropanamide IUPAC Name: (2R)-2-[(4-amino-5-benzylsulfanyl-1,2,4-triazol-3-yl)sulfanyl]-N-prop-2-enylpropanamide Traditional Name: (2R)-N-allyl-2-[[4-amino-5-(benzylthio)-1,2,4-triazol-3-yl]thio]propionamide Formula: C15H19N5OS2 MolecularWeight: 349.47426

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC=C)SC1=NN=C(N1N)SCC2=CC=CC=C2

Isomeric SMILES

C[C@H](C(=O)NCC=C)SC1=NN=C(N1N)SCC2=CC=CC=C2

InChI

InChI=1S/C15H19N5OS2/c1-3-9-17-13(21)11(2)23-15-19-18-14(20(15)16)22-10-12-7-5-4-6-8-12/h3-8,11H,1,9-10,16H2,2H3,(H,17,21)/t11-/m1/s1