2-(1,3-benzothiazol-2-yl)-2-(4,5-dimethyl-1,3-dithiol-2-ylidene)ethanenitrile

Systemtic Name: 2-(1,3-benzothiazol-2-yl)-2-(4,5-dimethyl-1,3-dithiol-2-ylidene)ethanenitrile Openeye Name: 2-(1,3-benzothiazol-2-yl)-2-(4,5-dimethyl-1,3-dithiol-2-ylidene)acetonitrile CAS Name: 2-(1,3-benzothiazol-2-yl)-2-(4,5-dimethyl-1,3-dithiol-2-ylidene)acetonitrile IUPAC Name: 2-(1,3-benzothiazol-2-yl)-2-(4,5-dimethyl-1,3-dithiol-2-ylidene)acetonitrile Traditional Name: 2-(1,3-benzothiazol-2-yl)-2-(4,5-dimethyl-1,3-dithiol-2-ylidene)acetonitrile Formula: C14H10N2S3 MolecularWeight: 302.4376

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C(C#N)C2=NC3=CC=CC=C3S2)S1)C

Isomeric SMILES

CC1=C(SC(=C(C#N)C2=NC3=CC=CC=C3S2)S1)C

InChI

InChI=1S/C14H10N2S3/c1-8-9(2)18-14(17-8)10(7-15)13-16-11-5-3-4-6-12(11)19-13/h3-6H,1-2H3