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

Systemtic Name: 3-[1-[(4-chlorophenyl)methyl]pyrazol-4-yl]-1-methyl-1-[(1-methylpyrazol-3-yl)methyl]thiourea Openeye Name: 3-[1-[(4-chlorophenyl)methyl]pyrazol-4-yl]-1-methyl-1-[(1-methylpyrazol-3-yl)methyl]thiourea CAS Name: 3-[1-[(4-chlorophenyl)methyl]-4-pyrazolyl]-1-methyl-1-[(1-methyl-3-pyrazolyl)methyl]thiourea IUPAC Name: 3-[1-[(4-chlorophenyl)methyl]pyrazol-4-yl]-1-methyl-1-[(1-methylpyrazol-3-yl)methyl]thiourea Traditional Name: 3-[1-(4-chlorobenzyl)pyrazol-4-yl]-1-methyl-1-[(1-methylpyrazol-3-yl)methyl]thiourea Formula: C17H19ClN6S MolecularWeight: 374.89096

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC(=N1)CN(C)C(=S)NC2=CN(N=C2)CC3=CC=C(C=C3)Cl

Isomeric SMILES

CN1C=CC(=N1)CN(C)C(=S)NC2=CN(N=C2)CC3=CC=C(C=C3)Cl

InChI

InChI=1S/C17H19ClN6S/c1-22(11-15-7-8-23(2)21-15)17(25)20-16-9-19-24(12-16)10-13-3-5-14(18)6-4-13/h3-9,12H,10-11H2,1-2H3,(H,20,25)