1-[2,3-bis(chloranyl)phenyl]-3-[(1-methylpyrazol-4-yl)methyl]thiourea

Systemtic Name: 1-[2,3-bis(chloranyl)phenyl]-3-[(1-methylpyrazol-4-yl)methyl]thiourea Openeye Name: 1-(2,3-dichlorophenyl)-3-[(1-methylpyrazol-4-yl)methyl]thiourea CAS Name: 1-(2,3-dichlorophenyl)-3-[(1-methyl-4-pyrazolyl)methyl]thiourea IUPAC Name: 1-(2,3-dichlorophenyl)-3-[(1-methylpyrazol-4-yl)methyl]thiourea Traditional Name: 1-(2,3-dichlorophenyl)-3-[(1-methylpyrazol-4-yl)methyl]thiourea Formula: C12H12Cl2N4S MolecularWeight: 315.22148

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)CNC(=S)NC2=C(C(=CC=C2)Cl)Cl

Isomeric SMILES

CN1C=C(C=N1)CNC(=S)NC2=C(C(=CC=C2)Cl)Cl

InChI

InChI=1S/C12H12Cl2N4S/c1-18-7-8(6-16-18)5-15-12(19)17-10-4-2-3-9(13)11(10)14/h2-4,6-7H,5H2,1H3,(H2,15,17,19)