1-(5-chloranyl-2-methyl-phenyl)-3-[(4-pyrazol-1-ylphenyl)methyl]thiourea

Systemtic Name: 1-(5-chloranyl-2-methyl-phenyl)-3-[(4-pyrazol-1-ylphenyl)methyl]thiourea Openeye Name: 1-(5-chloro-2-methyl-phenyl)-3-[(4-pyrazol-1-ylphenyl)methyl]thiourea CAS Name: 1-(5-chloro-2-methylphenyl)-3-[[4-(1-pyrazolyl)phenyl]methyl]thiourea IUPAC Name: 1-(5-chloro-2-methylphenyl)-3-[(4-pyrazol-1-ylphenyl)methyl]thiourea Traditional Name: 1-(5-chloro-2-methyl-phenyl)-3-(4-pyrazol-1-ylbenzyl)thiourea Formula: C18H17ClN4S MolecularWeight: 356.87238

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)NC(=S)NCC2=CC=C(C=C2)N3C=CC=N3

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)NC(=S)NCC2=CC=C(C=C2)N3C=CC=N3

InChI

InChI=1S/C18H17ClN4S/c1-13-3-6-15(19)11-17(13)22-18(24)20-12-14-4-7-16(8-5-14)23-10-2-9-21-23/h2-11H,12H2,1H3,(H2,20,22,24)