5-[5-bromanyl-1,3-bis(oxidanylidene)isoindol-2-yl]-3-[(2-chlorophenyl)methylsulfanyl]-1H-pyrazole-4-carbonitrile

Systemtic Name: 5-[5-bromanyl-1,3-bis(oxidanylidene)isoindol-2-yl]-3-[(2-chlorophenyl)methylsulfanyl]-1H-pyrazole-4-carbonitrile Openeye Name: 5-(5-bromo-1,3-dioxo-isoindolin-2-yl)-3-[(2-chlorophenyl)methylsulfanyl]-1H-pyrazole-4-carbonitrile CAS Name: 5-(5-bromo-1,3-dioxo-2-isoindolyl)-3-[(2-chlorophenyl)methylthio]-1H-pyrazole-4-carbonitrile IUPAC Name: 5-(5-bromo-1,3-dioxoisoindol-2-yl)-3-[(2-chlorophenyl)methylsulfanyl]-1H-pyrazole-4-carbonitrile Traditional Name: 5-(5-bromo-1,3-diketo-isoindolin-2-yl)-3-[(2-chlorobenzyl)thio]-1H-pyrazole-4-carbonitrile Formula: C19H10BrClN4O2S MolecularWeight: 473.7303

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CSC2=NNC(=C2C#N)N3C(=O)C4=C(C3=O)C=C(C=C4)Br)Cl

Isomeric SMILES

C1=CC=C(C(=C1)CSC2=NNC(=C2C#N)N3C(=O)C4=C(C3=O)C=C(C=C4)Br)Cl

InChI

InChI=1S/C19H10BrClN4O2S/c20-11-5-6-12-13(7-11)19(27)25(18(12)26)16-14(8-22)17(24-23-16)28-9-10-3-1-2-4-15(10)21/h1-7H,9H2,(H,23,24)