2-methyl-N-[3-(2-methylsulfanylethyl)-6-nitro-1,3-benzothiazol-2-ylidene]propanamide

Systemtic Name: 2-methyl-N-[3-(2-methylsulfanylethyl)-6-nitro-1,3-benzothiazol-2-ylidene]propanamide Openeye Name: 2-methyl-N-[3-(2-methylsulfanylethyl)-6-nitro-1,3-benzothiazol-2-ylidene]propanamide CAS Name: 2-methyl-N-[3-[2-(methylthio)ethyl]-6-nitro-1,3-benzothiazol-2-ylidene]propanamide IUPAC Name: 2-methyl-N-[3-(2-methylsulfanylethyl)-6-nitro-1,3-benzothiazol-2-ylidene]propanamide Traditional Name: 2-methyl-N-[3-[2-(methylthio)ethyl]-6-nitro-1,3-benzothiazol-2-ylidene]propionamide Formula: C14H17N3O3S2 MolecularWeight: 339.43308

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)N=C1N(C2=C(S1)C=C(C=C2)[N+](=O)[O-])CCSC

Isomeric SMILES

CC(C)C(=O)N=C1N(C2=C(S1)C=C(C=C2)[N+](=O)[O-])CCSC

InChI

InChI=1S/C14H17N3O3S2/c1-9(2)13(18)15-14-16(6-7-21-3)11-5-4-10(17(19)20)8-12(11)22-14/h4-5,8-9H,6-7H2,1-3H3