3-[4-[2,2-bis(1,3-benzothiazol-2-yl)ethenyl]-1-phenyl-pyrazol-3-yl]chromen-2-one

Systemtic Name: 3-[4-[2,2-bis(1,3-benzothiazol-2-yl)ethenyl]-1-phenyl-pyrazol-3-yl]chromen-2-one Openeye Name: 3-[4-[2,2-bis(1,3-benzothiazol-2-yl)vinyl]-1-phenyl-pyrazol-3-yl]chromen-2-one CAS Name: 3-[4-[2,2-bis(1,3-benzothiazol-2-yl)ethenyl]-1-phenyl-3-pyrazolyl]-1-benzopyran-2-one IUPAC Name: 3-[4-[2,2-bis(1,3-benzothiazol-2-yl)ethenyl]-1-phenylpyrazol-3-yl]chromen-2-one Traditional Name: 3-[4-[2,2-bis(1,3-benzothiazol-2-yl)vinyl]-1-phenyl-pyrazol-3-yl]coumarin Formula: C34H20N4O2S2 MolecularWeight: 580.6782

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC4=CC=CC=C4OC3=O)C=C(C5=NC6=CC=CC=C6S5)C7=NC8=CC=CC=C8S7

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC4=CC=CC=C4OC3=O)C=C(C5=NC6=CC=CC=C6S5)C7=NC8=CC=CC=C8S7

InChI

InChI=1S/C34H20N4O2S2/c39-34-24(18-21-10-4-7-15-28(21)40-34)31-22(20-38(37-31)23-11-2-1-3-12-23)19-25(32-35-26-13-5-8-16-29(26)41-32)33-36-27-14-6-9-17-30(27)42-33/h1-20H