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

Systemtic Name: N-(4-bromanyl-1,3-benzothiazol-2-yl)-4-(4-chlorophenyl)sulfanyl-butanamide Openeye Name: N-(4-bromo-1,3-benzothiazol-2-yl)-4-(4-chlorophenyl)sulfanyl-butanamide CAS Name: N-(4-bromo-1,3-benzothiazol-2-yl)-4-[(4-chlorophenyl)thio]butanamide IUPAC Name: N-(4-bromo-1,3-benzothiazol-2-yl)-4-(4-chlorophenyl)sulfanylbutanamide Traditional Name: N-(4-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=CC2=C(C(=C1)Br)N=C(S2)NC(=O)CCCSC3=CC=C(C=C3)Cl

Isomeric SMILES

C1=CC2=C(C(=C1)Br)N=C(S2)NC(=O)CCCSC3=CC=C(C=C3)Cl

InChI

InChI=1S/C17H14BrClN2OS2/c18-13-3-1-4-14-16(13)21-17(24-14)20-15(22)5-2-10-23-12-8-6-11(19)7-9-12/h1,3-4,6-9H,2,5,10H2,(H,20,21,22)