N-(6-bromanyl-1,3-benzothiazol-2-yl)-3-phenylsulfanyl-propanamide

Systemtic Name: N-(6-bromanyl-1,3-benzothiazol-2-yl)-3-phenylsulfanyl-propanamide Openeye Name: N-(6-bromo-1,3-benzothiazol-2-yl)-3-phenylsulfanyl-propanamide CAS Name: N-(6-bromo-1,3-benzothiazol-2-yl)-3-(phenylthio)propanamide IUPAC Name: N-(6-bromo-1,3-benzothiazol-2-yl)-3-phenylsulfanylpropanamide Traditional Name: N-(6-bromo-1,3-benzothiazol-2-yl)-3-(phenylthio)propionamide Formula: C16H13BrN2OS2 MolecularWeight: 393.32122

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H13BrN2OS2/c17-11-6-7-13-14(10-11)22-16(18-13)19-15(20)8-9-21-12-4-2-1-3-5-12/h1-7,10H,8-9H2,(H,18,19,20)