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

Systemtic Name: 4-(2-bromanyl-4-propan-2-yl-phenoxy)-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]butanamide Openeye Name: 4-(2-bromo-4-isopropyl-phenoxy)-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]butanamide CAS Name: 4-(2-bromo-4-propan-2-ylphenoxy)-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]butanamide IUPAC Name: 4-(2-bromo-4-propan-2-ylphenoxy)-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]butanamide Traditional Name: 4-(2-bromo-4-isopropyl-phenoxy)-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]butyramide Formula: C27H27BrN2O2S MolecularWeight: 523.48448

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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=C(C=C(C=C4)C(C)C)Br

Isomeric SMILES

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

InChI

InChI=1S/C27H27BrN2O2S/c1-17(2)20-9-13-24(22(28)16-20)32-14-4-5-26(31)29-21-10-7-19(8-11-21)27-30-23-12-6-18(3)15-25(23)33-27/h6-13,15-17H,4-5,14H2,1-3H3,(H,29,31)