N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]octanamide

Systemtic Name: N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]octanamide Openeye Name: N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]octanamide CAS Name: N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]octanamide IUPAC Name: N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]octanamide Traditional Name: N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]caprylamide Formula: C22H26N2OS MolecularWeight: 366.51964

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)NC1=CC=C(C=C1)C2=NC3=C(S2)C=C(C=C3)C

Isomeric SMILES

CCCCCCCC(=O)NC1=CC=C(C=C1)C2=NC3=C(S2)C=C(C=C3)C

InChI

InChI=1S/C22H26N2OS/c1-3-4-5-6-7-8-21(25)23-18-12-10-17(11-13-18)22-24-19-14-9-16(2)15-20(19)26-22/h9-15H,3-8H2,1-2H3,(H,23,25)