1-(3-methylsulfanylphenyl)-3-[4-(1,2,4-triazol-1-ylmethyl)phenyl]urea

Systemtic Name: 1-(3-methylsulfanylphenyl)-3-[4-(1,2,4-triazol-1-ylmethyl)phenyl]urea Openeye Name: 1-(3-methylsulfanylphenyl)-3-[4-(1,2,4-triazol-1-ylmethyl)phenyl]urea CAS Name: 1-[3-(methylthio)phenyl]-3-[4-(1,2,4-triazol-1-ylmethyl)phenyl]urea IUPAC Name: 1-(3-methylsulfanylphenyl)-3-[4-(1,2,4-triazol-1-ylmethyl)phenyl]urea Traditional Name: 1-[3-(methylthio)phenyl]-3-[4-(1,2,4-triazol-1-ylmethyl)phenyl]urea Formula: C17H17N5OS MolecularWeight: 339.41478

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC(=C1)NC(=O)NC2=CC=C(C=C2)CN3C=NC=N3

Isomeric SMILES

CSC1=CC=CC(=C1)NC(=O)NC2=CC=C(C=C2)CN3C=NC=N3

InChI

InChI=1S/C17H17N5OS/c1-24-16-4-2-3-15(9-16)21-17(23)20-14-7-5-13(6-8-14)10-22-12-18-11-19-22/h2-9,11-12H,10H2,1H3,(H2,20,21,23)