(4-chloranyl-3-nitro-phenyl)-[4-methyl-2-(methylamino)-3H-1,2-thiazol-5-yl]methanone

Systemtic Name: (4-chloranyl-3-nitro-phenyl)-[4-methyl-2-(methylamino)-3H-1,2-thiazol-5-yl]methanone Openeye Name: (4-chloro-3-nitro-phenyl)-[4-methyl-2-(methylamino)-3H-isothiazol-5-yl]methanone CAS Name: (4-chloro-3-nitrophenyl)-[4-methyl-2-(methylamino)-3H-isothiazol-5-yl]methanone IUPAC Name: (4-chloro-3-nitrophenyl)-[4-methyl-2-(methylamino)-3H-1,2-thiazol-5-yl]methanone Traditional Name: (4-chloro-3-nitro-phenyl)-[4-methyl-2-(methylamino)-4-isothiazolin-5-yl]methanone Formula: C12H12ClN3O3S MolecularWeight: 313.75998

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SN(C1)NC)C(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

CC1=C(SN(C1)NC)C(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C12H12ClN3O3S/c1-7-6-15(14-2)20-12(7)11(17)8-3-4-9(13)10(5-8)16(18)19/h3-5,14H,6H2,1-2H3