2-(2-methylphenyl)sulfanyl-N-(5-nitro-1,3-benzothiazol-2-yl)ethanamide

Systemtic Name: 2-(2-methylphenyl)sulfanyl-N-(5-nitro-1,3-benzothiazol-2-yl)ethanamide Openeye Name: N-(5-nitro-1,3-benzothiazol-2-yl)-2-(o-tolylsulfanyl)acetamide CAS Name: 2-[(2-methylphenyl)thio]-N-(5-nitro-1,3-benzothiazol-2-yl)acetamide IUPAC Name: 2-(2-methylphenyl)sulfanyl-N-(5-nitro-1,3-benzothiazol-2-yl)acetamide Traditional Name: N-(5-nitro-1,3-benzothiazol-2-yl)-2-(o-tolylthio)acetamide Formula: C16H13N3O3S2 MolecularWeight: 359.42272

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1SCC(=O)NC2=NC3=C(S2)C=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=CC=C1SCC(=O)NC2=NC3=C(S2)C=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H13N3O3S2/c1-10-4-2-3-5-13(10)23-9-15(20)18-16-17-12-8-11(19(21)22)6-7-14(12)24-16/h2-8H,9H2,1H3,(H,17,18,20)