3-methyl-6-nitro-2-(thiomorpholin-4-ylmethyl)aniline

Systemtic Name: 3-methyl-6-nitro-2-(thiomorpholin-4-ylmethyl)aniline Openeye Name: 3-methyl-6-nitro-2-(thiomorpholinomethyl)aniline CAS Name: 3-methyl-6-nitro-2-(thiomorpholin-4-ylmethyl)aniline IUPAC Name: 3-methyl-6-nitro-2-(thiomorpholin-4-ylmethyl)aniline Traditional Name: [3-methyl-6-nitro-2-(thiomorpholinomethyl)phenyl]amine Formula: C12H17N3O2S MolecularWeight: 267.34728

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)[N+](=O)[O-])N)CN2CCSCC2

Isomeric SMILES

CC1=C(C(=C(C=C1)[N+](=O)[O-])N)CN2CCSCC2

InChI

InChI=1S/C12H17N3O2S/c1-9-2-3-11(15(16)17)12(13)10(9)8-14-4-6-18-7-5-14/h2-3H,4-8,13H2,1H3