2-(2-cyanophenyl)sulfanyl-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)benzamide

Systemtic Name: 2-(2-cyanophenyl)sulfanyl-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)benzamide Openeye Name: 2-(2-cyanophenyl)sulfanyl-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)benzamide CAS Name: 2-[(2-cyanophenyl)thio]-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)benzamide IUPAC Name: 2-(2-cyanophenyl)sulfanyl-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)benzamide Traditional Name: 2-[(2-cyanophenyl)thio]-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)benzamide Formula: C21H17N3OS2 MolecularWeight: 391.50918

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)N=C(S2)NC(=O)C3=CC=CC=C3SC4=CC=CC=C4C#N

Isomeric SMILES

C1CCC2=C(C1)N=C(S2)NC(=O)C3=CC=CC=C3SC4=CC=CC=C4C#N

InChI

InChI=1S/C21H17N3OS2/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/h1-2,4-5,7-8,10-11H,3,6,9,12H2,(H,23,24,25)