N-(3-ethyl-6-nitro-1,3-benzothiazol-2-ylidene)-1-propan-2-yl-pyrazole-3-carboxamide

Systemtic Name: N-(3-ethyl-6-nitro-1,3-benzothiazol-2-ylidene)-1-propan-2-yl-pyrazole-3-carboxamide Openeye Name: N-(3-ethyl-6-nitro-1,3-benzothiazol-2-ylidene)-1-isopropyl-pyrazole-3-carboxamide CAS Name: N-(3-ethyl-6-nitro-1,3-benzothiazol-2-ylidene)-1-propan-2-yl-3-pyrazolecarboxamide IUPAC Name: N-(3-ethyl-6-nitro-1,3-benzothiazol-2-ylidene)-1-propan-2-ylpyrazole-3-carboxamide Traditional Name: N-(3-ethyl-6-nitro-1,3-benzothiazol-2-ylidene)-1-isopropyl-pyrazole-3-carboxamide Formula: C16H17N5O3S MolecularWeight: 359.40288

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)[N+](=O)[O-])SC1=NC(=O)C3=NN(C=C3)C(C)C

Isomeric SMILES

CCN1C2=C(C=C(C=C2)[N+](=O)[O-])SC1=NC(=O)C3=NN(C=C3)C(C)C

InChI

InChI=1S/C16H17N5O3S/c1-4-19-13-6-5-11(21(23)24)9-14(13)25-16(19)17-15(22)12-7-8-20(18-12)10(2)3/h5-10H,4H2,1-3H3