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

Systemtic Name: N-(1,3-benzothiazol-2-ylmethyl)-2-(2-cyanophenyl)sulfanyl-benzamide Openeye Name: N-(1,3-benzothiazol-2-ylmethyl)-2-(2-cyanophenyl)sulfanyl-benzamide CAS Name: N-(1,3-benzothiazol-2-ylmethyl)-2-[(2-cyanophenyl)thio]benzamide IUPAC Name: N-(1,3-benzothiazol-2-ylmethyl)-2-(2-cyanophenyl)sulfanylbenzamide Traditional Name: N-(1,3-benzothiazol-2-ylmethyl)-2-[(2-cyanophenyl)thio]benzamide Formula: C22H15N3OS2 MolecularWeight: 401.504

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C#N)SC2=CC=CC=C2C(=O)NCC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1=CC=C(C(=C1)C#N)SC2=CC=CC=C2C(=O)NCC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C22H15N3OS2/c23-13-15-7-1-4-10-18(15)27-19-11-5-2-8-16(19)22(26)24-14-21-25-17-9-3-6-12-20(17)28-21/h1-12H,14H2,(H,24,26)