1,1-dimethyl-3-[[3-[(2-methyl-5-sulfanyl-phenyl)methyl]-1,2,4-thiadiazol-5-yl]amino]urea

Systemtic Name: 1,1-dimethyl-3-[[3-[(2-methyl-5-sulfanyl-phenyl)methyl]-1,2,4-thiadiazol-5-yl]amino]urea Openeye Name: 1,1-dimethyl-3-[[3-[(2-methyl-5-sulfanyl-phenyl)methyl]-1,2,4-thiadiazol-5-yl]amino]urea CAS Name: 3-[[3-[(5-mercapto-2-methylphenyl)methyl]-1,2,4-thiadiazol-5-yl]amino]-1,1-dimethylurea IUPAC Name: 1,1-dimethyl-3-[[3-[(2-methyl-5-sulfanylphenyl)methyl]-1,2,4-thiadiazol-5-yl]amino]urea Traditional Name: 3-[[3-(5-mercapto-2-methyl-benzyl)-1,2,4-thiadiazol-5-yl]amino]-1,1-dimethyl-urea Formula: C13H17N5OS2 MolecularWeight: 323.43698

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S)CC2=NSC(=N2)NNC(=O)N(C)C

Isomeric SMILES

CC1=C(C=C(C=C1)S)CC2=NSC(=N2)NNC(=O)N(C)C

InChI

InChI=1S/C13H17N5OS2/c1-8-4-5-10(20)6-9(8)7-11-14-12(21-17-11)15-16-13(19)18(2)3/h4-6,20H,7H2,1-3H3,(H,16,19)(H,14,15,17)