1-[1-[(4-chlorophenyl)methyl]pyrazol-3-yl]-3-[(1-ethyl-5-methyl-pyrazol-4-yl)methyl]thiourea

Systemtic Name: 1-[1-[(4-chlorophenyl)methyl]pyrazol-3-yl]-3-[(1-ethyl-5-methyl-pyrazol-4-yl)methyl]thiourea Openeye Name: 1-[1-[(4-chlorophenyl)methyl]pyrazol-3-yl]-3-[(1-ethyl-5-methyl-pyrazol-4-yl)methyl]thiourea CAS Name: 1-[1-[(4-chlorophenyl)methyl]-3-pyrazolyl]-3-[(1-ethyl-5-methyl-4-pyrazolyl)methyl]thiourea IUPAC Name: 1-[1-[(4-chlorophenyl)methyl]pyrazol-3-yl]-3-[(1-ethyl-5-methylpyrazol-4-yl)methyl]thiourea Traditional Name: 1-[1-(4-chlorobenzyl)pyrazol-3-yl]-3-[(1-ethyl-5-methyl-pyrazol-4-yl)methyl]thiourea Formula: C18H21ClN6S MolecularWeight: 388.91754

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H21ClN6S/c1-3-25-13(2)15(11-21-25)10-20-18(26)22-17-8-9-24(23-17)12-14-4-6-16(19)7-5-14/h4-9,11H,3,10,12H2,1-2H3,(H2,20,22,23,26)