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

Systemtic Name: 4-(4-chloranyl-3-methyl-phenoxy)-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]butanamide Openeye Name: 4-(4-chloro-3-methyl-phenoxy)-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]butanamide CAS Name: 4-(4-chloro-3-methylphenoxy)-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]butanamide IUPAC Name: 4-(4-chloro-3-methylphenoxy)-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]butanamide Traditional Name: 4-(4-chloro-3-methyl-phenoxy)-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]butyramide Formula: C25H23ClN2O2S MolecularWeight: 450.98032

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)NC(=O)CCCOC4=CC(=C(C=C4)Cl)C

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)NC(=O)CCCOC4=CC(=C(C=C4)Cl)C

InChI

InChI=1S/C25H23ClN2O2S/c1-16-5-12-22-23(14-16)31-25(28-22)18-6-8-19(9-7-18)27-24(29)4-3-13-30-20-10-11-21(26)17(2)15-20/h5-12,14-15H,3-4,13H2,1-2H3,(H,27,29)