3-(3-chloranyl-4-methyl-phenyl)-1-phenethyl-1-(thiophen-2-ylmethyl)thiourea

Systemtic Name: 3-(3-chloranyl-4-methyl-phenyl)-1-phenethyl-1-(thiophen-2-ylmethyl)thiourea Openeye Name: 3-(3-chloro-4-methyl-phenyl)-1-phenethyl-1-(2-thienylmethyl)thiourea CAS Name: 3-(3-chloro-4-methylphenyl)-1-phenethyl-1-(thiophen-2-ylmethyl)thiourea IUPAC Name: 3-(3-chloro-4-methylphenyl)-1-phenethyl-1-(thiophen-2-ylmethyl)thiourea Traditional Name: 3-(3-chloro-4-methyl-phenyl)-1-phenethyl-1-(2-thenyl)thiourea Formula: C21H21ClN2S2 MolecularWeight: 400.98784

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=S)N(CCC2=CC=CC=C2)CC3=CC=CS3)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=S)N(CCC2=CC=CC=C2)CC3=CC=CS3)Cl

InChI

InChI=1S/C21H21ClN2S2/c1-16-9-10-18(14-20(16)22)23-21(25)24(15-19-8-5-13-26-19)12-11-17-6-3-2-4-7-17/h2-10,13-14H,11-12,15H2,1H3,(H,23,25)