methyl 5-(4-chlorophenyl)-2-[(4-chlorophenyl)-phenylsulfanyl-carbamoyl]-4-methyl-3H-pyrazole-4-carboxylate

Systemtic Name: methyl 5-(4-chlorophenyl)-2-[(4-chlorophenyl)-phenylsulfanyl-carbamoyl]-4-methyl-3H-pyrazole-4-carboxylate Openeye Name: methyl 5-(4-chlorophenyl)-2-[(4-chlorophenyl)-phenylsulfanyl-carbamoyl]-4-methyl-3H-pyrazole-4-carboxylate CAS Name: 5-(4-chlorophenyl)-2-[(4-chloro-N-(phenylthio)anilino)-oxomethyl]-4-methyl-3H-pyrazole-4-carboxylic acid methyl ester IUPAC Name: methyl 5-(4-chlorophenyl)-2-[(4-chlorophenyl)-phenylsulfanylcarbamoyl]-4-methyl-3H-pyrazole-4-carboxylate Traditional Name: 3-(4-chlorophenyl)-1-[(4-chlorophenyl)-(phenylthio)carbamoyl]-4-methyl-2-pyrazoline-4-carboxylic acid methyl ester Formula: C25H21Cl2N3O3S MolecularWeight: 514.42354

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CN(N=C1C2=CC=C(C=C2)Cl)C(=O)N(C3=CC=C(C=C3)Cl)SC4=CC=CC=C4)C(=O)OC

Isomeric SMILES

CC1(CN(N=C1C2=CC=C(C=C2)Cl)C(=O)N(C3=CC=C(C=C3)Cl)SC4=CC=CC=C4)C(=O)OC

InChI

InChI=1S/C25H21Cl2N3O3S/c1-25(23(31)33-2)16-29(28-22(25)17-8-10-18(26)11-9-17)24(32)30(20-14-12-19(27)13-15-20)34-21-6-4-3-5-7-21/h3-15H,16H2,1-2H3