N-[3-(2-ethoxyethyl)-6-nitro-1,3-benzothiazol-2-ylidene]-5-methyl-1-propan-2-yl-pyrazole-3-carboxamide

Systemtic Name: N-[3-(2-ethoxyethyl)-6-nitro-1,3-benzothiazol-2-ylidene]-5-methyl-1-propan-2-yl-pyrazole-3-carboxamide Openeye Name: N-[3-(2-ethoxyethyl)-6-nitro-1,3-benzothiazol-2-ylidene]-1-isopropyl-5-methyl-pyrazole-3-carboxamide CAS Name: N-[3-(2-ethoxyethyl)-6-nitro-1,3-benzothiazol-2-ylidene]-5-methyl-1-propan-2-yl-3-pyrazolecarboxamide IUPAC Name: N-[3-(2-ethoxyethyl)-6-nitro-1,3-benzothiazol-2-ylidene]-5-methyl-1-propan-2-ylpyrazole-3-carboxamide Traditional Name: N-[3-(2-ethoxyethyl)-6-nitro-1,3-benzothiazol-2-ylidene]-1-isopropyl-5-methyl-pyrazole-3-carboxamide Formula: C19H23N5O4S MolecularWeight: 417.48202

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCN1C2=C(C=C(C=C2)[N+](=O)[O-])SC1=NC(=O)C3=NN(C(=C3)C)C(C)C

Isomeric SMILES

CCOCCN1C2=C(C=C(C=C2)[N+](=O)[O-])SC1=NC(=O)C3=NN(C(=C3)C)C(C)C

InChI

InChI=1S/C19H23N5O4S/c1-5-28-9-8-22-16-7-6-14(24(26)27)11-17(16)29-19(22)20-18(25)15-10-13(4)23(21-15)12(2)3/h6-7,10-12H,5,8-9H2,1-4H3