nitrobenzene; N-(5-sulfanyl-1,3-thiazol-2-yl)ethanamide

Systemtic Name: nitrobenzene; N-(5-sulfanyl-1,3-thiazol-2-yl)ethanamide Openeye Name: nitrobenzene; N-(5-sulfanylthiazol-2-yl)acetamide CAS Name: N-(5-mercapto-2-thiazolyl)acetamide; nitrobenzene IUPAC Name: nitrobenzene; N-(5-sulfanyl-1,3-thiazol-2-yl)acetamide Traditional Name: N-(5-mercaptothiazol-2-yl)acetamide; nitrobenzene Formula: C11H11N3O3S2 MolecularWeight: 297.35334

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=NC=C(S1)S.C1=CC=C(C=C1)[N+](=O)[O-]

Isomeric SMILES

CC(=O)NC1=NC=C(S1)S.C1=CC=C(C=C1)[N+](=O)[O-]

InChI

InChI=1S/C6H5NO2.C5H6N2OS2/c8-7(9)6-4-2-1-3-5-6;1-3(8)7-5-6-2-4(9)10-5/h1-5H;2,9H,1H3,(H,6,7,8)