2-iodanyl-N-methyl-4-(6-nitro-1,3-benzothiazol-2-yl)aniline

Systemtic Name: 2-iodanyl-N-methyl-4-(6-nitro-1,3-benzothiazol-2-yl)aniline Openeye Name: 2-iodo-N-methyl-4-(6-nitro-1,3-benzothiazol-2-yl)aniline CAS Name: 2-iodo-N-methyl-4-(6-nitro-1,3-benzothiazol-2-yl)aniline IUPAC Name: 2-iodo-N-methyl-4-(6-nitro-1,3-benzothiazol-2-yl)aniline Traditional Name: [2-iodo-4-(6-nitro-1,3-benzothiazol-2-yl)phenyl]-methyl-amine Formula: C14H10IN3O2S MolecularWeight: 411.21757

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=C(C=C(C=C1)C2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-])I

Isomeric SMILES

CNC1=C(C=C(C=C1)C2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-])I

InChI

InChI=1S/C14H10IN3O2S/c1-16-11-4-2-8(6-10(11)15)14-17-12-5-3-9(18(19)20)7-13(12)21-14/h2-7,16H,1H3