N-(3-ethyl-5-nitro-1,3-benzothiazol-2-ylidene)-2-(4-methylphenyl)sulfanyl-ethanamide

Systemtic Name: N-(3-ethyl-5-nitro-1,3-benzothiazol-2-ylidene)-2-(4-methylphenyl)sulfanyl-ethanamide Openeye Name: N-(3-ethyl-5-nitro-1,3-benzothiazol-2-ylidene)-2-(p-tolylsulfanyl)acetamide CAS Name: N-(3-ethyl-5-nitro-1,3-benzothiazol-2-ylidene)-2-[(4-methylphenyl)thio]acetamide IUPAC Name: N-(3-ethyl-5-nitro-1,3-benzothiazol-2-ylidene)-2-(4-methylphenyl)sulfanylacetamide Traditional Name: N-(3-ethyl-5-nitro-1,3-benzothiazol-2-ylidene)-2-(p-tolylthio)acetamide Formula: C18H17N3O3S2 MolecularWeight: 387.47588

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=CC(=C2)[N+](=O)[O-])SC1=NC(=O)CSC3=CC=C(C=C3)C

Isomeric SMILES

CCN1C2=C(C=CC(=C2)[N+](=O)[O-])SC1=NC(=O)CSC3=CC=C(C=C3)C

InChI

InChI=1S/C18H17N3O3S2/c1-3-20-15-10-13(21(23)24)6-9-16(15)26-18(20)19-17(22)11-25-14-7-4-12(2)5-8-14/h4-10H,3,11H2,1-2H3