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

Systemtic Name: (4-azanyl-3-nitro-phenyl)-[4-ethyl-2-(methylamino)-3H-1,2-thiazol-5-yl]methanone Openeye Name: (4-amino-3-nitro-phenyl)-[4-ethyl-2-(methylamino)-3H-isothiazol-5-yl]methanone CAS Name: (4-amino-3-nitrophenyl)-[4-ethyl-2-(methylamino)-3H-isothiazol-5-yl]methanone IUPAC Name: (4-amino-3-nitrophenyl)-[4-ethyl-2-(methylamino)-3H-1,2-thiazol-5-yl]methanone Traditional Name: (4-amino-3-nitro-phenyl)-[4-ethyl-2-(methylamino)-4-isothiazolin-5-yl]methanone Formula: C13H16N4O3S MolecularWeight: 308.35614

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SN(C1)NC)C(=O)C2=CC(=C(C=C2)N)[N+](=O)[O-]

Isomeric SMILES

CCC1=C(SN(C1)NC)C(=O)C2=CC(=C(C=C2)N)[N+](=O)[O-]

InChI

InChI=1S/C13H16N4O3S/c1-3-8-7-16(15-2)21-13(8)12(18)9-4-5-10(14)11(6-9)17(19)20/h4-6,15H,3,7,14H2,1-2H3