1-[2-[4-(4-chloranyl-2-methyl-phenyl)piperazin-1-yl]ethyl]-3-(4-methoxyphenyl)thiourea

Systemtic Name: 1-[2-[4-(4-chloranyl-2-methyl-phenyl)piperazin-1-yl]ethyl]-3-(4-methoxyphenyl)thiourea Openeye Name: 1-[2-[4-(4-chloro-2-methyl-phenyl)piperazin-1-yl]ethyl]-3-(4-methoxyphenyl)thiourea CAS Name: 1-[2-[4-(4-chloro-2-methylphenyl)-1-piperazinyl]ethyl]-3-(4-methoxyphenyl)thiourea IUPAC Name: 1-[2-[4-(4-chloro-2-methylphenyl)piperazin-1-yl]ethyl]-3-(4-methoxyphenyl)thiourea Traditional Name: 1-[2-[4-(4-chloro-2-methyl-phenyl)piperazino]ethyl]-3-(4-methoxyphenyl)thiourea Formula: C21H27ClN4OS MolecularWeight: 418.98328

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Cl)N2CCN(CC2)CCNC(=S)NC3=CC=C(C=C3)OC

Isomeric SMILES

CC1=C(C=CC(=C1)Cl)N2CCN(CC2)CCNC(=S)NC3=CC=C(C=C3)OC

InChI

InChI=1S/C21H27ClN4OS/c1-16-15-17(22)3-8-20(16)26-13-11-25(12-14-26)10-9-23-21(28)24-18-4-6-19(27-2)7-5-18/h3-8,15H,9-14H2,1-2H3,(H2,23,24,28)