4-chloranyl-N-[2-(naphthalen-1-ylmethylsulfanyl)-1,3-benzothiazol-6-yl]benzamide

Systemtic Name: 4-chloranyl-N-[2-(naphthalen-1-ylmethylsulfanyl)-1,3-benzothiazol-6-yl]benzamide Openeye Name: 4-chloro-N-[2-(1-naphthylmethylsulfanyl)-1,3-benzothiazol-6-yl]benzamide CAS Name: 4-chloro-N-[2-(1-naphthalenylmethylthio)-1,3-benzothiazol-6-yl]benzamide IUPAC Name: 4-chloro-N-[2-(naphthalen-1-ylmethylsulfanyl)-1,3-benzothiazol-6-yl]benzamide Traditional Name: 4-chloro-N-[2-(1-naphthylmethylthio)-1,3-benzothiazol-6-yl]benzamide Formula: C25H17ClN2OS2 MolecularWeight: 460.99828

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2CSC3=NC4=C(S3)C=C(C=C4)NC(=O)C5=CC=C(C=C5)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2CSC3=NC4=C(S3)C=C(C=C4)NC(=O)C5=CC=C(C=C5)Cl

InChI

InChI=1S/C25H17ClN2OS2/c26-19-10-8-17(9-11-19)24(29)27-20-12-13-22-23(14-20)31-25(28-22)30-15-18-6-3-5-16-4-1-2-7-21(16)18/h1-14H,15H2,(H,27,29)