N-(1,3-benzothiazol-2-yl)-2-(2-cyanophenyl)sulfanyl-benzamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-2-(2-cyanophenyl)sulfanyl-benzamide Openeye Name: N-(1,3-benzothiazol-2-yl)-2-(2-cyanophenyl)sulfanyl-benzamide CAS Name: N-(1,3-benzothiazol-2-yl)-2-[(2-cyanophenyl)thio]benzamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-2-(2-cyanophenyl)sulfanylbenzamide Traditional Name: N-(1,3-benzothiazol-2-yl)-2-[(2-cyanophenyl)thio]benzamide Formula: C21H13N3OS2 MolecularWeight: 387.47742

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C#N)SC2=CC=CC=C2C(=O)NC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1=CC=C(C(=C1)C#N)SC2=CC=CC=C2C(=O)NC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C21H13N3OS2/c22-13-14-7-1-4-10-17(14)26-18-11-5-2-8-15(18)20(25)24-21-23-16-9-3-6-12-19(16)27-21/h1-12H,(H,23,24,25)