2-[(2-methyl-1,3-benzothiazol-6-yl)amino]-5-nitro-benzenecarbonitrile

Systemtic Name: 2-[(2-methyl-1,3-benzothiazol-6-yl)amino]-5-nitro-benzenecarbonitrile Openeye Name: 2-[(2-methyl-1,3-benzothiazol-6-yl)amino]-5-nitro-benzonitrile CAS Name: 2-[(2-methyl-1,3-benzothiazol-6-yl)amino]-5-nitrobenzonitrile IUPAC Name: 2-[(2-methyl-1,3-benzothiazol-6-yl)amino]-5-nitrobenzonitrile Traditional Name: 2-[(2-methyl-1,3-benzothiazol-6-yl)amino]-5-nitro-benzonitrile Formula: C15H10N4O2S MolecularWeight: 310.3305

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(S1)C=C(C=C2)NC3=C(C=C(C=C3)[N+](=O)[O-])C#N

Isomeric SMILES

CC1=NC2=C(S1)C=C(C=C2)NC3=C(C=C(C=C3)[N+](=O)[O-])C#N

InChI

InChI=1S/C15H10N4O2S/c1-9-17-14-4-2-11(7-15(14)22-9)18-13-5-3-12(19(20)21)6-10(13)8-16/h2-7,18H,1H3