3-[3-(3-bromophenyl)-1-phenyl-pyrazol-4-yl]-2-cyano-prop-2-enethioamide

Systemtic Name: 3-[3-(3-bromophenyl)-1-phenyl-pyrazol-4-yl]-2-cyano-prop-2-enethioamide Openeye Name: 3-[3-(3-bromophenyl)-1-phenyl-pyrazol-4-yl]-2-cyano-prop-2-enethioamide CAS Name: 3-[3-(3-bromophenyl)-1-phenyl-4-pyrazolyl]-2-cyano-2-propenethioamide IUPAC Name: 3-[3-(3-bromophenyl)-1-phenylpyrazol-4-yl]-2-cyanoprop-2-enethioamide Traditional Name: 3-[3-(3-bromophenyl)-1-phenyl-pyrazol-4-yl]-2-cyano-thioacrylamide Formula: C19H13BrN4S MolecularWeight: 409.30232

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC(=CC=C3)Br)C=C(C#N)C(=S)N

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC(=CC=C3)Br)C=C(C#N)C(=S)N

InChI

InChI=1S/C19H13BrN4S/c20-16-6-4-5-13(10-16)18-15(9-14(11-21)19(22)25)12-24(23-18)17-7-2-1-3-8-17/h1-10,12H,(H2,22,25)