2-(4-methoxy-3-methyl-phenyl)-N-[3-(2-methylsulfanylethyl)-6-nitro-1,3-benzothiazol-2-ylidene]ethanamide

Systemtic Name: 2-(4-methoxy-3-methyl-phenyl)-N-[3-(2-methylsulfanylethyl)-6-nitro-1,3-benzothiazol-2-ylidene]ethanamide Openeye Name: 2-(4-methoxy-3-methyl-phenyl)-N-[3-(2-methylsulfanylethyl)-6-nitro-1,3-benzothiazol-2-ylidene]acetamide CAS Name: 2-(4-methoxy-3-methylphenyl)-N-[3-[2-(methylthio)ethyl]-6-nitro-1,3-benzothiazol-2-ylidene]acetamide IUPAC Name: 2-(4-methoxy-3-methylphenyl)-N-[3-(2-methylsulfanylethyl)-6-nitro-1,3-benzothiazol-2-ylidene]acetamide Traditional Name: 2-(4-methoxy-3-methyl-phenyl)-N-[3-[2-(methylthio)ethyl]-6-nitro-1,3-benzothiazol-2-ylidene]acetamide Formula: C20H21N3O4S2 MolecularWeight: 431.52844

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)CC(=O)N=C2N(C3=C(S2)C=C(C=C3)[N+](=O)[O-])CCSC)OC

Isomeric SMILES

CC1=C(C=CC(=C1)CC(=O)N=C2N(C3=C(S2)C=C(C=C3)[N+](=O)[O-])CCSC)OC

InChI

InChI=1S/C20H21N3O4S2/c1-13-10-14(4-7-17(13)27-2)11-19(24)21-20-22(8-9-28-3)16-6-5-15(23(25)26)12-18(16)29-20/h4-7,10,12H,8-9,11H2,1-3H3