5-nitro-2-[(E)-2-[1-(phenylmethyl)pyrazol-4-yl]ethenyl]-1,3-benzothiazole

Systemtic Name: 5-nitro-2-[(E)-2-[1-(phenylmethyl)pyrazol-4-yl]ethenyl]-1,3-benzothiazole Openeye Name: 2-[(E)-2-(1-benzylpyrazol-4-yl)vinyl]-5-nitro-1,3-benzothiazole CAS Name: 5-nitro-2-[(E)-2-[1-(phenylmethyl)-4-pyrazolyl]ethenyl]-1,3-benzothiazole IUPAC Name: 2-[(E)-2-(1-benzylpyrazol-4-yl)ethenyl]-5-nitro-1,3-benzothiazole Traditional Name: 2-[(E)-2-(1-benzylpyrazol-4-yl)vinyl]-5-nitro-1,3-benzothiazole Formula: C19H14N4O2S MolecularWeight: 362.40506

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=C(C=N2)C=CC3=NC4=C(S3)C=CC(=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CN2C=C(C=N2)/C=C/C3=NC4=C(S3)C=CC(=C4)[N+](=O)[O-]

InChI

InChI=1S/C19H14N4O2S/c24-23(25)16-7-8-18-17(10-16)21-19(26-18)9-6-15-11-20-22(13-15)12-14-4-2-1-3-5-14/h1-11,13H,12H2/b9-6+