2-methyl-5-(4-methylsulfonyl-2-nitro-phenoxy)thieno[2,3-e][1,3]benzothiazole

Systemtic Name: 2-methyl-5-(4-methylsulfonyl-2-nitro-phenoxy)thieno[2,3-e][1,3]benzothiazole Openeye Name: 2-methyl-5-(4-methylsulfonyl-2-nitro-phenoxy)thieno[2,3-e][1,3]benzothiazole CAS Name: 2-methyl-5-(4-methylsulfonyl-2-nitrophenoxy)thieno[2,3-e][1,3]benzothiazole IUPAC Name: 2-methyl-5-(4-methylsulfonyl-2-nitrophenoxy)thieno[2,3-e][1,3]benzothiazole Traditional Name: 5-(4-mesyl-2-nitro-phenoxy)-2-methyl-thieno[2,3-e][1,3]benzothiazole Formula: C17H12N2O5S3 MolecularWeight: 420.48258

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(S1)C=C(C3=C2SC=C3)OC4=C(C=C(C=C4)S(=O)(=O)C)[N+](=O)[O-]

Isomeric SMILES

CC1=NC2=C(S1)C=C(C3=C2SC=C3)OC4=C(C=C(C=C4)S(=O)(=O)C)[N+](=O)[O-]

InChI

InChI=1S/C17H12N2O5S3/c1-9-18-16-15(26-9)8-14(11-5-6-25-17(11)16)24-13-4-3-10(27(2,22)23)7-12(13)19(20)21/h3-8H,1-2H3