(2Z)-2-[(E)-3-(1,3-benzothiazol-3-ium-2-yl)prop-2-enylidene]-3H-1,3-benzothiazole

Systemtic Name: (2Z)-2-[(E)-3-(1,3-benzothiazol-3-ium-2-yl)prop-2-enylidene]-3H-1,3-benzothiazole Openeye Name: (2Z)-2-[(E)-3-(1,3-benzothiazol-3-ium-2-yl)prop-2-enylidene]-3H-1,3-benzothiazole CAS Name: (2Z)-2-[(E)-3-(1,3-benzothiazol-3-ium-2-yl)prop-2-enylidene]-3H-1,3-benzothiazole IUPAC Name: (2Z)-2-[(E)-3-(1,3-benzothiazol-3-ium-2-yl)prop-2-enylidene]-3H-1,3-benzothiazole Traditional Name: (2Z)-2-[(E)-3-(1,3-benzothiazol-3-ium-2-yl)prop-2-enylidene]-3H-1,3-benzothiazole Formula: C17H13N2S2+ MolecularWeight: 309.42852

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=CC=CC3=[NH+]C4=CC=CC=C4S3)S2

Isomeric SMILES

C1=CC=C2C(=C1)N/C(=C/C=C/C3=[NH+]C4=CC=CC=C4S3)/S2

InChI

InChI=1S/C17H12N2S2/c1-3-8-14-12(6-1)18-16(20-14)10-5-11-17-19-13-7-2-4-9-15(13)21-17/h1-11,18H/p+1/b11-5+,16-10-