N,N-dimethyl-4-[(E)-2-pyrimido[2,1-b][1,3]benzothiazol-5-ium-4-ylethenyl]aniline

Systemtic Name: N,N-dimethyl-4-[(E)-2-pyrimido[2,1-b][1,3]benzothiazol-5-ium-4-ylethenyl]aniline Openeye Name: N,N-dimethyl-4-[(E)-2-pyrimido[2,1-b][1,3]benzothiazol-5-ium-4-ylvinyl]aniline CAS Name: N,N-dimethyl-4-[(E)-2-(4-pyrimido[2,1-b][1,3]benzothiazol-5-iumyl)ethenyl]aniline IUPAC Name: N,N-dimethyl-4-[(E)-2-pyrimido[2,1-b][1,3]benzothiazol-5-ium-4-ylethenyl]aniline Traditional Name: dimethyl-[4-[(E)-2-pyrimido[2,1-b][1,3]benzothiazol-5-ium-4-ylvinyl]phenyl]amine Formula: C20H18N3S+ MolecularWeight: 332.44202

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C=CC2=[N+]3C4=CC=CC=C4SC3=NC=C2

Isomeric SMILES

CN(C)C1=CC=C(C=C1)/C=C/C2=[N+]3C4=CC=CC=C4SC3=NC=C2

InChI

InChI=1S/C20H18N3S/c1-22(2)16-10-7-15(8-11-16)9-12-17-13-14-21-20-23(17)18-5-3-4-6-19(18)24-20/h3-14H,1-2H3/q+1