5-[3,5-bis(chloranyl)phenyl]sulfanyl-1-cyclopentyl-3-methyl-4-(phenylmethyl)pyrazole

Systemtic Name: 5-[3,5-bis(chloranyl)phenyl]sulfanyl-1-cyclopentyl-3-methyl-4-(phenylmethyl)pyrazole Openeye Name: 4-benzyl-1-cyclopentyl-5-(3,5-dichlorophenyl)sulfanyl-3-methyl-pyrazole CAS Name: 1-cyclopentyl-5-[(3,5-dichlorophenyl)thio]-3-methyl-4-(phenylmethyl)pyrazole IUPAC Name: 4-benzyl-1-cyclopentyl-5-(3,5-dichlorophenyl)sulfanyl-3-methylpyrazole Traditional Name: 4-benzyl-1-cyclopentyl-5-[(3,5-dichlorophenyl)thio]-3-methyl-pyrazole Formula: C22H22Cl2N2S MolecularWeight: 417.39448

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1CC2=CC=CC=C2)SC3=CC(=CC(=C3)Cl)Cl)C4CCCC4

Isomeric SMILES

CC1=NN(C(=C1CC2=CC=CC=C2)SC3=CC(=CC(=C3)Cl)Cl)C4CCCC4

InChI

InChI=1S/C22H22Cl2N2S/c1-15-21(11-16-7-3-2-4-8-16)22(26(25-15)19-9-5-6-10-19)27-20-13-17(23)12-18(24)14-20/h2-4,7-8,12-14,19H,5-6,9-11H2,1H3