(Z)-2-pyrazin-2-yl-3-[3-[[3-(2-sulfanylethyl)-1,3-benzothiazol-2-ylidene]amino]phenyl]prop-2-enal

Systemtic Name: (Z)-2-pyrazin-2-yl-3-[3-[[3-(2-sulfanylethyl)-1,3-benzothiazol-2-ylidene]amino]phenyl]prop-2-enal Openeye Name: (Z)-2-pyrazin-2-yl-3-[3-[[3-(2-sulfanylethyl)-1,3-benzothiazol-2-ylidene]amino]phenyl]prop-2-enal CAS Name: (Z)-3-[3-[[3-(2-mercaptoethyl)-1,3-benzothiazol-2-ylidene]amino]phenyl]-2-(2-pyrazinyl)-2-propenal IUPAC Name: (Z)-2-pyrazin-2-yl-3-[3-[[3-(2-sulfanylethyl)-1,3-benzothiazol-2-ylidene]amino]phenyl]prop-2-enal Traditional Name: (Z)-3-[3-[[3-(2-mercaptoethyl)-1,3-benzothiazol-2-ylidene]amino]phenyl]-2-pyrazin-2-yl-acrolein Formula: C22H18N4OS2 MolecularWeight: 418.53452

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N(C(=NC3=CC=CC(=C3)C=C(C=O)C4=NC=CN=C4)S2)CCS

Isomeric SMILES

C1=CC=C2C(=C1)N(C(=NC3=CC=CC(=C3)/C=C(\C=O)/C4=NC=CN=C4)S2)CCS

InChI

InChI=1S/C22H18N4OS2/c27-15-17(19-14-23-8-9-24-19)12-16-4-3-5-18(13-16)25-22-26(10-11-28)20-6-1-2-7-21(20)29-22/h1-9,12-15,28H,10-11H2/b17-12+,25-22?