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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C=N1)CNC(=S)NC2=CN(N=C2)CC3=CC=C(C=C3)Cl

Isomeric SMILES

CCN1C=C(C=N1)CNC(=S)NC2=CN(N=C2)CC3=CC=C(C=C3)Cl

InChI

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