1-(5-chloranyl-2-phenylsulfanyl-phenyl)-3-[3-(dimethylamino)propyl]thiourea

Systemtic Name: 1-(5-chloranyl-2-phenylsulfanyl-phenyl)-3-[3-(dimethylamino)propyl]thiourea Openeye Name: 1-(5-chloro-2-phenylsulfanyl-phenyl)-3-[3-(dimethylamino)propyl]thiourea CAS Name: 1-[5-chloro-2-(phenylthio)phenyl]-3-[3-(dimethylamino)propyl]thiourea IUPAC Name: 1-(5-chloro-2-phenylsulfanylphenyl)-3-[3-(dimethylamino)propyl]thiourea Traditional Name: 1-[5-chloro-2-(phenylthio)phenyl]-3-[3-(dimethylamino)propyl]thiourea Formula: C18H22ClN3S2 MolecularWeight: 379.97038

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCNC(=S)NC1=C(C=CC(=C1)Cl)SC2=CC=CC=C2

Isomeric SMILES

CN(C)CCCNC(=S)NC1=C(C=CC(=C1)Cl)SC2=CC=CC=C2

InChI

InChI=1S/C18H22ClN3S2/c1-22(2)12-6-11-20-18(23)21-16-13-14(19)9-10-17(16)24-15-7-4-3-5-8-15/h3-5,7-10,13H,6,11-12H2,1-2H3,(H2,20,21,23)