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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=C1CNC(=S)NC2=NN(C=C2)CC3=CC=C(C=C3)Cl)C

Isomeric SMILES

CC1=NN(C=C1CNC(=S)NC2=NN(C=C2)CC3=CC=C(C=C3)Cl)C

InChI

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