4-(1,3-benzothiazol-2-yl)-N-[2,4-bis(bromanyl)phenyl]butanamide

Systemtic Name: 4-(1,3-benzothiazol-2-yl)-N-[2,4-bis(bromanyl)phenyl]butanamide Openeye Name: 4-(1,3-benzothiazol-2-yl)-N-(2,4-dibromophenyl)butanamide CAS Name: 4-(1,3-benzothiazol-2-yl)-N-(2,4-dibromophenyl)butanamide IUPAC Name: 4-(1,3-benzothiazol-2-yl)-N-(2,4-dibromophenyl)butanamide Traditional Name: 4-(1,3-benzothiazol-2-yl)-N-(2,4-dibromophenyl)butyramide Formula: C17H14Br2N2OS MolecularWeight: 454.17886

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)CCCC(=O)NC3=C(C=C(C=C3)Br)Br

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)CCCC(=O)NC3=C(C=C(C=C3)Br)Br

InChI

InChI=1S/C17H14Br2N2OS/c18-11-8-9-13(12(19)10-11)20-16(22)6-3-7-17-21-14-4-1-2-5-15(14)23-17/h1-2,4-5,8-10H,3,6-7H2,(H,20,22)