2-(3-azanyl-5-phenethylsulfanyl-1,2,4-triazol-4-yl)-N-(furan-2-ylmethyl)ethanamide

Systemtic Name: 2-(3-azanyl-5-phenethylsulfanyl-1,2,4-triazol-4-yl)-N-(furan-2-ylmethyl)ethanamide Openeye Name: 2-(3-amino-5-phenethylsulfanyl-1,2,4-triazol-4-yl)-N-(2-furylmethyl)acetamide CAS Name: 2-[3-amino-5-(phenethylthio)-1,2,4-triazol-4-yl]-N-(2-furanylmethyl)acetamide IUPAC Name: 2-(3-amino-5-phenethylsulfanyl-1,2,4-triazol-4-yl)-N-(furan-2-ylmethyl)acetamide Traditional Name: 2-[3-amino-5-(phenethylthio)-1,2,4-triazol-4-yl]-N-(2-furfuryl)acetamide Formula: C17H19N5O2S MolecularWeight: 357.43006

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCSC2=NN=C(N2CC(=O)NCC3=CC=CO3)N

Isomeric SMILES

C1=CC=C(C=C1)CCSC2=NN=C(N2CC(=O)NCC3=CC=CO3)N

InChI

InChI=1S/C17H19N5O2S/c18-16-20-21-17(25-10-8-13-5-2-1-3-6-13)22(16)12-15(23)19-11-14-7-4-9-24-14/h1-7,9H,8,10-12H2,(H2,18,20)(H,19,23)