1-methyl-3-[2-[2-phenyl-1-(1,2,3-triazol-1-yl)ethyl]sulfanylethyl]thiourea

Systemtic Name: 1-methyl-3-[2-[2-phenyl-1-(1,2,3-triazol-1-yl)ethyl]sulfanylethyl]thiourea Openeye Name: 1-methyl-3-[2-[2-phenyl-1-(triazol-1-yl)ethyl]sulfanylethyl]thiourea CAS Name: 1-methyl-3-[2-[[2-phenyl-1-(1-triazolyl)ethyl]thio]ethyl]thiourea IUPAC Name: 1-methyl-3-[2-[2-phenyl-1-(triazol-1-yl)ethyl]sulfanylethyl]thiourea Traditional Name: 1-methyl-3-[2-[[2-phenyl-1-(triazol-1-yl)ethyl]thio]ethyl]thiourea Formula: C14H19N5S2 MolecularWeight: 321.46416

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=S)NCCSC(CC1=CC=CC=C1)N2C=CN=N2

Isomeric SMILES

CNC(=S)NCCSC(CC1=CC=CC=C1)N2C=CN=N2

InChI

InChI=1S/C14H19N5S2/c1-15-14(20)16-8-10-21-13(19-9-7-17-18-19)11-12-5-3-2-4-6-12/h2-7,9,13H,8,10-11H2,1H3,(H2,15,16,20)