methyl 3-[[(Z)-(3-methyl-1,3-benzothiazol-2-ylidene)amino]carbamoyl]-5-nitro-benzoate

Systemtic Name: methyl 3-[[(Z)-(3-methyl-1,3-benzothiazol-2-ylidene)amino]carbamoyl]-5-nitro-benzoate Openeye Name: methyl 3-[[(Z)-(3-methyl-1,3-benzothiazol-2-ylidene)amino]carbamoyl]-5-nitro-benzoate CAS Name: 3-[[(2Z)-2-(3-methyl-1,3-benzothiazol-2-ylidene)hydrazinyl]-oxomethyl]-5-nitrobenzoic acid methyl ester IUPAC Name: methyl 3-[[(Z)-(3-methyl-1,3-benzothiazol-2-ylidene)amino]carbamoyl]-5-nitrobenzoate Traditional Name: 3-[[(Z)-(3-methyl-1,3-benzothiazol-2-ylidene)amino]carbamoyl]-5-nitro-benzoic acid methyl ester Formula: C17H14N4O5S MolecularWeight: 386.38186

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2SC1=NNC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])C(=O)OC

Isomeric SMILES

CN\1C2=CC=CC=C2S/C1=N\NC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C17H14N4O5S/c1-20-13-5-3-4-6-14(13)27-17(20)19-18-15(22)10-7-11(16(23)26-2)9-12(8-10)21(24)25/h3-9H,1-2H3,(H,18,22)/b19-17-