N-[2-(1,3-benzothiazol-2-yl)-4-chloranyl-phenyl]-3-butoxy-benzamide

Systemtic Name: N-[2-(1,3-benzothiazol-2-yl)-4-chloranyl-phenyl]-3-butoxy-benzamide Openeye Name: N-[2-(1,3-benzothiazol-2-yl)-4-chloro-phenyl]-3-butoxy-benzamide CAS Name: N-[2-(1,3-benzothiazol-2-yl)-4-chlorophenyl]-3-butoxybenzamide IUPAC Name: N-[2-(1,3-benzothiazol-2-yl)-4-chlorophenyl]-3-butoxybenzamide Traditional Name: N-[2-(1,3-benzothiazol-2-yl)-4-chloro-phenyl]-3-butoxy-benzamide Formula: C24H21ClN2O2S MolecularWeight: 436.95374

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC(=C1)C(=O)NC2=C(C=C(C=C2)Cl)C3=NC4=CC=CC=C4S3

Isomeric SMILES

CCCCOC1=CC=CC(=C1)C(=O)NC2=C(C=C(C=C2)Cl)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C24H21ClN2O2S/c1-2-3-13-29-18-8-6-7-16(14-18)23(28)26-20-12-11-17(25)15-19(20)24-27-21-9-4-5-10-22(21)30-24/h4-12,14-15H,2-3,13H2,1H3,(H,26,28)