N-(6-bromanyl-1,3-benzothiazol-2-yl)-4-(4-chlorophenyl)sulfanyl-butanamide

Systemtic Name: N-(6-bromanyl-1,3-benzothiazol-2-yl)-4-(4-chlorophenyl)sulfanyl-butanamide Openeye Name: N-(6-bromo-1,3-benzothiazol-2-yl)-4-(4-chlorophenyl)sulfanyl-butanamide CAS Name: N-(6-bromo-1,3-benzothiazol-2-yl)-4-[(4-chlorophenyl)thio]butanamide IUPAC Name: N-(6-bromo-1,3-benzothiazol-2-yl)-4-(4-chlorophenyl)sulfanylbutanamide Traditional Name: N-(6-bromo-1,3-benzothiazol-2-yl)-4-[(4-chlorophenyl)thio]butyramide Formula: C17H14BrClN2OS2 MolecularWeight: 441.79286

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1SCCCC(=O)NC2=NC3=C(S2)C=C(C=C3)Br)Cl

Isomeric SMILES

C1=CC(=CC=C1SCCCC(=O)NC2=NC3=C(S2)C=C(C=C3)Br)Cl

InChI

InChI=1S/C17H14BrClN2OS2/c18-11-3-8-14-15(10-11)24-17(20-14)21-16(22)2-1-9-23-13-6-4-12(19)5-7-13/h3-8,10H,1-2,9H2,(H,20,21,22)