N-(1,3-benzothiazol-2-ylmethyl)-4-(3-bromanylphenoxy)butanamide

Systemtic Name: N-(1,3-benzothiazol-2-ylmethyl)-4-(3-bromanylphenoxy)butanamide Openeye Name: N-(1,3-benzothiazol-2-ylmethyl)-4-(3-bromophenoxy)butanamide CAS Name: N-(1,3-benzothiazol-2-ylmethyl)-4-(3-bromophenoxy)butanamide IUPAC Name: N-(1,3-benzothiazol-2-ylmethyl)-4-(3-bromophenoxy)butanamide Traditional Name: N-(1,3-benzothiazol-2-ylmethyl)-4-(3-bromophenoxy)butyramide Formula: C18H17BrN2O2S MolecularWeight: 405.30878

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)CNC(=O)CCCOC3=CC(=CC=C3)Br

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)CNC(=O)CCCOC3=CC(=CC=C3)Br

InChI

InChI=1S/C18H17BrN2O2S/c19-13-5-3-6-14(11-13)23-10-4-9-17(22)20-12-18-21-15-7-1-2-8-16(15)24-18/h1-3,5-8,11H,4,9-10,12H2,(H,20,22)