3-methyl-4-nitro-N-(phenylmethyl)-1,2-thiazol-5-amine

Systemtic Name: 3-methyl-4-nitro-N-(phenylmethyl)-1,2-thiazol-5-amine Openeye Name: N-benzyl-3-methyl-4-nitro-isothiazol-5-amine CAS Name: 3-methyl-4-nitro-N-(phenylmethyl)-5-isothiazolamine IUPAC Name: N-benzyl-3-methyl-4-nitro-1,2-thiazol-5-amine Traditional Name: benzyl-(3-methyl-4-nitro-isothiazol-5-yl)amine Formula: C11H11N3O2S MolecularWeight: 249.28894

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NSC(=C1[N+](=O)[O-])NCC2=CC=CC=C2

Isomeric SMILES

CC1=NSC(=C1[N+](=O)[O-])NCC2=CC=CC=C2

InChI

InChI=1S/C11H11N3O2S/c1-8-10(14(15)16)11(17-13-8)12-7-9-5-3-2-4-6-9/h2-6,12H,7H2,1H3