4-cyano-N-(3,6-dimethyl-1,3-benzothiazol-2-ylidene)benzamide

Systemtic Name: 4-cyano-N-(3,6-dimethyl-1,3-benzothiazol-2-ylidene)benzamide Openeye Name: 4-cyano-N-(3,6-dimethyl-1,3-benzothiazol-2-ylidene)benzamide CAS Name: 4-cyano-N-(3,6-dimethyl-1,3-benzothiazol-2-ylidene)benzamide IUPAC Name: 4-cyano-N-(3,6-dimethyl-1,3-benzothiazol-2-ylidene)benzamide Traditional Name: 4-cyano-N-(3,6-dimethyl-1,3-benzothiazol-2-ylidene)benzamide Formula: C17H13N3OS MolecularWeight: 307.36962

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(C(=NC(=O)C3=CC=C(C=C3)C#N)S2)C

Isomeric SMILES

CC1=CC2=C(C=C1)N(C(=NC(=O)C3=CC=C(C=C3)C#N)S2)C

InChI

InChI=1S/C17H13N3OS/c1-11-3-8-14-15(9-11)22-17(20(14)2)19-16(21)13-6-4-12(10-18)5-7-13/h3-9H,1-2H3