3-(3-chloranyl-4-methyl-phenyl)-1-methyl-1-[(1-phenylpyrazol-4-yl)methyl]thiourea

Systemtic Name: 3-(3-chloranyl-4-methyl-phenyl)-1-methyl-1-[(1-phenylpyrazol-4-yl)methyl]thiourea Openeye Name: 3-(3-chloro-4-methyl-phenyl)-1-methyl-1-[(1-phenylpyrazol-4-yl)methyl]thiourea CAS Name: 3-(3-chloro-4-methylphenyl)-1-methyl-1-[(1-phenyl-4-pyrazolyl)methyl]thiourea IUPAC Name: 3-(3-chloro-4-methylphenyl)-1-methyl-1-[(1-phenylpyrazol-4-yl)methyl]thiourea Traditional Name: 3-(3-chloro-4-methyl-phenyl)-1-methyl-1-[(1-phenylpyrazol-4-yl)methyl]thiourea Formula: C19H19ClN4S MolecularWeight: 370.89896

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=S)N(C)CC2=CN(N=C2)C3=CC=CC=C3)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=S)N(C)CC2=CN(N=C2)C3=CC=CC=C3)Cl

InChI

InChI=1S/C19H19ClN4S/c1-14-8-9-16(10-18(14)20)22-19(25)23(2)12-15-11-21-24(13-15)17-6-4-3-5-7-17/h3-11,13H,12H2,1-2H3,(H,22,25)