1-(3-chlorophenyl)-3-[4-(cyclohexen-1-yl)-2,5-dimethyl-pyrazol-3-yl]urea

Systemtic Name: 1-(3-chlorophenyl)-3-[4-(cyclohexen-1-yl)-2,5-dimethyl-pyrazol-3-yl]urea Openeye Name: 1-(3-chlorophenyl)-3-[4-(cyclohexen-1-yl)-2,5-dimethyl-pyrazol-3-yl]urea CAS Name: 1-(3-chlorophenyl)-3-[4-(1-cyclohexenyl)-2,5-dimethyl-3-pyrazolyl]urea IUPAC Name: 1-(3-chlorophenyl)-3-[4-(cyclohexen-1-yl)-2,5-dimethylpyrazol-3-yl]urea Traditional Name: 1-(3-chlorophenyl)-3-[4-(cyclohexen-1-yl)-2,5-dimethyl-pyrazol-3-yl]urea Formula: C18H21ClN4O MolecularWeight: 344.83854

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C2=CCCCC2)NC(=O)NC3=CC(=CC=C3)Cl)C

Isomeric SMILES

CC1=NN(C(=C1C2=CCCCC2)NC(=O)NC3=CC(=CC=C3)Cl)C

InChI

InChI=1S/C18H21ClN4O/c1-12-16(13-7-4-3-5-8-13)17(23(2)22-12)21-18(24)20-15-10-6-9-14(19)11-15/h6-7,9-11H,3-5,8H2,1-2H3,(H2,20,21,24)