1-methyl-3-(2,3,4,6-tetrahydro-1,5-benzodithiocin-8-yl)urea

Systemtic Name: 1-methyl-3-(2,3,4,6-tetrahydro-1,5-benzodithiocin-8-yl)urea Openeye Name: 1-methyl-3-(2,3,4,6-tetrahydro-1,5-benzodithiocin-8-yl)urea CAS Name: 1-methyl-3-(2,3,4,6-tetrahydro-1,5-benzodithiocin-8-yl)urea IUPAC Name: 1-methyl-3-(2,3,4,6-tetrahydro-1,5-benzodithiocin-8-yl)urea Traditional Name: 1-methyl-3-(2,3,4,6-tetrahydro-1,5-benzodithiocin-8-yl)urea Formula: C12H16N2OS2 MolecularWeight: 268.39824

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)NC1=CC2=C(C=C1)SCCCSC2

Isomeric SMILES

CNC(=O)NC1=CC2=C(C=C1)SCCCSC2

InChI

InChI=1S/C12H16N2OS2/c1-13-12(15)14-10-3-4-11-9(7-10)8-16-5-2-6-17-11/h3-4,7H,2,5-6,8H2,1H3,(H2,13,14,15)