N-(3-methyl-6-methylsulfonyl-1,3-benzothiazol-2-ylidene)-3-phenylsulfanyl-propanamide

Systemtic Name: N-(3-methyl-6-methylsulfonyl-1,3-benzothiazol-2-ylidene)-3-phenylsulfanyl-propanamide Openeye Name: N-(3-methyl-6-methylsulfonyl-1,3-benzothiazol-2-ylidene)-3-phenylsulfanyl-propanamide CAS Name: N-(3-methyl-6-methylsulfonyl-1,3-benzothiazol-2-ylidene)-3-(phenylthio)propanamide IUPAC Name: N-(3-methyl-6-methylsulfonyl-1,3-benzothiazol-2-ylidene)-3-phenylsulfanylpropanamide Traditional Name: N-(6-mesyl-3-methyl-1,3-benzothiazol-2-ylidene)-3-(phenylthio)propionamide Formula: C18H18N2O3S3 MolecularWeight: 406.54212

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)S(=O)(=O)C)SC1=NC(=O)CCSC3=CC=CC=C3

Isomeric SMILES

CN1C2=C(C=C(C=C2)S(=O)(=O)C)SC1=NC(=O)CCSC3=CC=CC=C3

InChI

InChI=1S/C18H18N2O3S3/c1-20-15-9-8-14(26(2,22)23)12-16(15)25-18(20)19-17(21)10-11-24-13-6-4-3-5-7-13/h3-9,12H,10-11H2,1-2H3