1,1-dimethyl-3-(1-phenyl-3-sulfanyl-propan-2-yl)urea

Systemtic Name: 1,1-dimethyl-3-(1-phenyl-3-sulfanyl-propan-2-yl)urea Openeye Name: 3-(1-benzyl-2-sulfanyl-ethyl)-1,1-dimethyl-urea CAS Name: 3-(1-mercapto-3-phenylpropan-2-yl)-1,1-dimethylurea IUPAC Name: 1,1-dimethyl-3-(1-phenyl-3-sulfanylpropan-2-yl)urea Traditional Name: 3-(1-benzyl-2-mercapto-ethyl)-1,1-dimethyl-urea Formula: C12H18N2OS MolecularWeight: 238.34912

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)NC(CC1=CC=CC=C1)CS

Isomeric SMILES

CN(C)C(=O)NC(CC1=CC=CC=C1)CS

InChI

InChI=1S/C12H18N2OS/c1-14(2)12(15)13-11(9-16)8-10-6-4-3-5-7-10/h3-7,11,16H,8-9H2,1-2H3,(H,13,15)