1-(2-chlorophenyl)-3-[(1-methylpyrazol-3-yl)methyl]thiourea

Systemtic Name: 1-(2-chlorophenyl)-3-[(1-methylpyrazol-3-yl)methyl]thiourea Openeye Name: 1-(2-chlorophenyl)-3-[(1-methylpyrazol-3-yl)methyl]thiourea CAS Name: 1-(2-chlorophenyl)-3-[(1-methyl-3-pyrazolyl)methyl]thiourea IUPAC Name: 1-(2-chlorophenyl)-3-[(1-methylpyrazol-3-yl)methyl]thiourea Traditional Name: 1-(2-chlorophenyl)-3-[(1-methylpyrazol-3-yl)methyl]thiourea Formula: C12H13ClN4S MolecularWeight: 280.77642

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC(=N1)CNC(=S)NC2=CC=CC=C2Cl

Isomeric SMILES

CN1C=CC(=N1)CNC(=S)NC2=CC=CC=C2Cl

InChI

InChI=1S/C12H13ClN4S/c1-17-7-6-9(16-17)8-14-12(18)15-11-5-3-2-4-10(11)13/h2-7H,8H2,1H3,(H2,14,15,18)