3-[(4-methylphenyl)sulfonylamino]-N-(5-nitro-1,3-thiazol-2-yl)propanamide

Systemtic Name: 3-[(4-methylphenyl)sulfonylamino]-N-(5-nitro-1,3-thiazol-2-yl)propanamide Openeye Name: N-(5-nitrothiazol-2-yl)-3-(p-tolylsulfonylamino)propanamide CAS Name: 3-[(4-methylphenyl)sulfonylamino]-N-(5-nitro-2-thiazolyl)propanamide IUPAC Name: 3-[(4-methylphenyl)sulfonylamino]-N-(5-nitro-1,3-thiazol-2-yl)propanamide Traditional Name: N-(5-nitrothiazol-2-yl)-3-(tosylamino)propionamide Formula: C13H14N4O5S2 MolecularWeight: 370.40406

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NCCC(=O)NC2=NC=C(S2)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NCCC(=O)NC2=NC=C(S2)[N+](=O)[O-]

InChI

InChI=1S/C13H14N4O5S2/c1-9-2-4-10(5-3-9)24(21,22)15-7-6-11(18)16-13-14-8-12(23-13)17(19)20/h2-5,8,15H,6-7H2,1H3,(H,14,16,18)