2-[(E)-(3-ethyl-1,3-benzothiazol-2-ylidene)methyl]-3-prop-2-enyl-1,3-thiazol-3-ium-4-one

Systemtic Name: 2-[(E)-(3-ethyl-1,3-benzothiazol-2-ylidene)methyl]-3-prop-2-enyl-1,3-thiazol-3-ium-4-one Openeye Name: 3-allyl-2-[(E)-(3-ethyl-1,3-benzothiazol-2-ylidene)methyl]thiazol-3-ium-4-one CAS Name: 2-[(E)-(3-ethyl-1,3-benzothiazol-2-ylidene)methyl]-3-prop-2-enyl-4-thiazol-3-iumone IUPAC Name: 2-[(E)-(3-ethyl-1,3-benzothiazol-2-ylidene)methyl]-3-prop-2-enyl-1,3-thiazol-3-ium-4-one Traditional Name: 3-allyl-2-[(E)-(3-ethyl-1,3-benzothiazol-2-ylidene)methyl]-2-thiazolin-3-ium-4-one Formula: C16H17N2OS2+ MolecularWeight: 317.44898

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2SC1=CC3=[N+](C(=O)CS3)CC=C

Isomeric SMILES

CCN\1C2=CC=CC=C2S/C1=C/C3=[N+](C(=O)CS3)CC=C

InChI

InChI=1S/C16H17N2OS2/c1-3-9-18-14(19)11-20-15(18)10-16-17(4-2)12-7-5-6-8-13(12)21-16/h3,5-8,10H,1,4,9,11H2,2H3/q+1