1-(phenylmethyl)-N-(5-prop-2-enylsulfanyl-1,3,4-thiadiazol-2-yl)-1,2,3-triazole-4-carboxamide

Systemtic Name: 1-(phenylmethyl)-N-(5-prop-2-enylsulfanyl-1,3,4-thiadiazol-2-yl)-1,2,3-triazole-4-carboxamide Openeye Name: N-(5-allylsulfanyl-1,3,4-thiadiazol-2-yl)-1-benzyl-triazole-4-carboxamide CAS Name: 1-(phenylmethyl)-N-[5-(prop-2-enylthio)-1,3,4-thiadiazol-2-yl]-4-triazolecarboxamide IUPAC Name: 1-benzyl-N-(5-prop-2-enylsulfanyl-1,3,4-thiadiazol-2-yl)triazole-4-carboxamide Traditional Name: N-[5-(allylthio)-1,3,4-thiadiazol-2-yl]-1-benzyl-triazole-4-carboxamide Formula: C15H14N6OS2 MolecularWeight: 358.44126

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CCSC1=NN=C(S1)NC(=O)C2=CN(N=N2)CC3=CC=CC=C3

Isomeric SMILES

C=CCSC1=NN=C(S1)NC(=O)C2=CN(N=N2)CC3=CC=CC=C3

InChI

InChI=1S/C15H14N6OS2/c1-2-8-23-15-19-18-14(24-15)16-13(22)12-10-21(20-17-12)9-11-6-4-3-5-7-11/h2-7,10H,1,8-9H2,(H,16,18,22)