1-(2-methyl-1,3-benzoxazol-5-yl)-3-(3-methylsulfanylpropyl)thiourea

Systemtic Name: 1-(2-methyl-1,3-benzoxazol-5-yl)-3-(3-methylsulfanylpropyl)thiourea Openeye Name: 1-(2-methyl-1,3-benzoxazol-5-yl)-3-(3-methylsulfanylpropyl)thiourea CAS Name: 1-(2-methyl-1,3-benzoxazol-5-yl)-3-[3-(methylthio)propyl]thiourea IUPAC Name: 1-(2-methyl-1,3-benzoxazol-5-yl)-3-(3-methylsulfanylpropyl)thiourea Traditional Name: 1-(2-methyl-1,3-benzoxazol-5-yl)-3-[3-(methylthio)propyl]thiourea Formula: C13H17N3OS2 MolecularWeight: 295.42358

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(O1)C=CC(=C2)NC(=S)NCCCSC

Isomeric SMILES

CC1=NC2=C(O1)C=CC(=C2)NC(=S)NCCCSC

InChI

InChI=1S/C13H17N3OS2/c1-9-15-11-8-10(4-5-12(11)17-9)16-13(18)14-6-3-7-19-2/h4-5,8H,3,6-7H2,1-2H3,(H2,14,16,18)