1-[(4-chlorophenyl)methyl]-3-[(1-methylpyrazol-4-yl)methyl]thiourea

Systemtic Name: 1-[(4-chlorophenyl)methyl]-3-[(1-methylpyrazol-4-yl)methyl]thiourea Openeye Name: 1-[(4-chlorophenyl)methyl]-3-[(1-methylpyrazol-4-yl)methyl]thiourea CAS Name: 1-[(4-chlorophenyl)methyl]-3-[(1-methyl-4-pyrazolyl)methyl]thiourea IUPAC Name: 1-[(4-chlorophenyl)methyl]-3-[(1-methylpyrazol-4-yl)methyl]thiourea Traditional Name: 1-(4-chlorobenzyl)-3-[(1-methylpyrazol-4-yl)methyl]thiourea Formula: C13H15ClN4S MolecularWeight: 294.803

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)CNC(=S)NCC2=CC=C(C=C2)Cl

Isomeric SMILES

CN1C=C(C=N1)CNC(=S)NCC2=CC=C(C=C2)Cl

InChI

InChI=1S/C13H15ClN4S/c1-18-9-11(8-17-18)7-16-13(19)15-6-10-2-4-12(14)5-3-10/h2-5,8-9H,6-7H2,1H3,(H2,15,16,19)