2-(1,3-benzothiazol-2-ylsulfanyl)-3-[3-(5-methylfuran-2-yl)-1-phenyl-pyrazol-4-yl]prop-2-enenitrile

Systemtic Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-3-[3-(5-methylfuran-2-yl)-1-phenyl-pyrazol-4-yl]prop-2-enenitrile Openeye Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-3-[3-(5-methyl-2-furyl)-1-phenyl-pyrazol-4-yl]prop-2-enenitrile CAS Name: 2-(1,3-benzothiazol-2-ylthio)-3-[3-(5-methyl-2-furanyl)-1-phenyl-4-pyrazolyl]-2-propenenitrile IUPAC Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-3-[3-(5-methylfuran-2-yl)-1-phenylpyrazol-4-yl]prop-2-enenitrile Traditional Name: 2-(1,3-benzothiazol-2-ylthio)-3-[3-(5-methyl-2-furyl)-1-phenyl-pyrazol-4-yl]acrylonitrile Formula: C24H16N4OS2 MolecularWeight: 440.54004

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)C2=NN(C=C2C=C(C#N)SC3=NC4=CC=CC=C4S3)C5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(O1)C2=NN(C=C2C=C(C#N)SC3=NC4=CC=CC=C4S3)C5=CC=CC=C5

InChI

InChI=1S/C24H16N4OS2/c1-16-11-12-21(29-16)23-17(15-28(27-23)18-7-3-2-4-8-18)13-19(14-25)30-24-26-20-9-5-6-10-22(20)31-24/h2-13,15H,1H3