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

Systemtic Name: N-(3-methyl-5-nitro-1,3-benzothiazol-2-ylidene)-2-(4-methylphenyl)sulfanyl-ethanamide Openeye Name: N-(3-methyl-5-nitro-1,3-benzothiazol-2-ylidene)-2-(p-tolylsulfanyl)acetamide CAS Name: N-(3-methyl-5-nitro-1,3-benzothiazol-2-ylidene)-2-[(4-methylphenyl)thio]acetamide IUPAC Name: N-(3-methyl-5-nitro-1,3-benzothiazol-2-ylidene)-2-(4-methylphenyl)sulfanylacetamide Traditional Name: N-(3-methyl-5-nitro-1,3-benzothiazol-2-ylidene)-2-(p-tolylthio)acetamide Formula: C17H15N3O3S2 MolecularWeight: 373.4493

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H15N3O3S2/c1-11-3-6-13(7-4-11)24-10-16(21)18-17-19(2)14-9-12(20(22)23)5-8-15(14)25-17/h3-9H,10H2,1-2H3