1-[3-[[(E)-1-(3-methyl-1,3-benzothiazol-3-ium-2-yl)prop-1-en-2-yl]amino]phenyl]ethanone

Systemtic Name: 1-[3-[[(E)-1-(3-methyl-1,3-benzothiazol-3-ium-2-yl)prop-1-en-2-yl]amino]phenyl]ethanone Openeye Name: 1-[3-[[(E)-1-methyl-2-(3-methyl-1,3-benzothiazol-3-ium-2-yl)vinyl]amino]phenyl]ethanone CAS Name: 1-[3-[[(E)-1-(3-methyl-1,3-benzothiazol-3-ium-2-yl)prop-1-en-2-yl]amino]phenyl]ethanone IUPAC Name: 1-[3-[[(E)-1-(3-methyl-1,3-benzothiazol-3-ium-2-yl)prop-1-en-2-yl]amino]phenyl]ethanone Traditional Name: 1-[3-[[(E)-1-methyl-2-(3-methyl-1,3-benzothiazol-3-ium-2-yl)vinyl]amino]phenyl]ethanone Formula: C19H19N2OS+ MolecularWeight: 323.43196

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC1=[N+](C2=CC=CC=C2S1)C)NC3=CC=CC(=C3)C(=O)C

Isomeric SMILES

C/C(=C\C1=[N+](C2=CC=CC=C2S1)C)/NC3=CC=CC(=C3)C(=O)C

InChI

InChI=1S/C19H18N2OS/c1-13(20-16-8-6-7-15(12-16)14(2)22)11-19-21(3)17-9-4-5-10-18(17)23-19/h4-12H,1-3H3/p+1