1-[(3-chlorophenyl)methyl]-3-(3-methylsulfanylpropyl)thiourea

Systemtic Name: 1-[(3-chlorophenyl)methyl]-3-(3-methylsulfanylpropyl)thiourea Openeye Name: 1-[(3-chlorophenyl)methyl]-3-(3-methylsulfanylpropyl)thiourea CAS Name: 1-[(3-chlorophenyl)methyl]-3-[3-(methylthio)propyl]thiourea IUPAC Name: 1-[(3-chlorophenyl)methyl]-3-(3-methylsulfanylpropyl)thiourea Traditional Name: 1-(3-chlorobenzyl)-3-[3-(methylthio)propyl]thiourea Formula: C12H17ClN2S2 MolecularWeight: 288.85978

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSCCCNC(=S)NCC1=CC(=CC=C1)Cl

Isomeric SMILES

CSCCCNC(=S)NCC1=CC(=CC=C1)Cl

InChI

InChI=1S/C12H17ClN2S2/c1-17-7-3-6-14-12(16)15-9-10-4-2-5-11(13)8-10/h2,4-5,8H,3,6-7,9H2,1H3,(H2,14,15,16)