1,3-bis[3-(3-methylphenyl)sulfanylpropyl]urea

Systemtic Name: 1,3-bis[3-(3-methylphenyl)sulfanylpropyl]urea Openeye Name: 1,3-bis[3-(m-tolylsulfanyl)propyl]urea CAS Name: 1,3-bis[3-[(3-methylphenyl)thio]propyl]urea IUPAC Name: 1,3-bis[3-(3-methylphenyl)sulfanylpropyl]urea Traditional Name: 1,3-bis[3-(m-tolylthio)propyl]urea Formula: C21H28N2OS2 MolecularWeight: 388.58982

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)SCCCNC(=O)NCCCSC2=CC=CC(=C2)C

Isomeric SMILES

CC1=CC(=CC=C1)SCCCNC(=O)NCCCSC2=CC=CC(=C2)C

InChI

InChI=1S/C21H28N2OS2/c1-17-7-3-9-19(15-17)25-13-5-11-22-21(24)23-12-6-14-26-20-10-4-8-18(2)16-20/h3-4,7-10,15-16H,5-6,11-14H2,1-2H3,(H2,22,23,24)