3-[(E)-2-[4-(1,3-benzothiazol-2-yl)phenyl]ethenyl]-6-bromanyl-chromen-2-one

Systemtic Name: 3-[(E)-2-[4-(1,3-benzothiazol-2-yl)phenyl]ethenyl]-6-bromanyl-chromen-2-one Openeye Name: 3-[(E)-2-[4-(1,3-benzothiazol-2-yl)phenyl]vinyl]-6-bromo-chromen-2-one CAS Name: 3-[(E)-2-[4-(1,3-benzothiazol-2-yl)phenyl]ethenyl]-6-bromo-1-benzopyran-2-one IUPAC Name: 3-[(E)-2-[4-(1,3-benzothiazol-2-yl)phenyl]ethenyl]-6-bromochromen-2-one Traditional Name: 3-[(E)-2-[4-(1,3-benzothiazol-2-yl)phenyl]vinyl]-6-bromo-coumarin Formula: C24H14BrNO2S MolecularWeight: 460.34246

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)C3=CC=C(C=C3)C=CC4=CC5=C(C=CC(=C5)Br)OC4=O

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)C3=CC=C(C=C3)/C=C/C4=CC5=C(C=CC(=C5)Br)OC4=O

InChI

InChI=1S/C24H14BrNO2S/c25-19-11-12-21-18(14-19)13-17(24(27)28-21)10-7-15-5-8-16(9-6-15)23-26-20-3-1-2-4-22(20)29-23/h1-14H/b10-7+