N-[(Z)-[2,5-dimethyl-1-(2-propan-2-ylpyrazol-3-yl)pyrrol-3-yl]methylideneamino]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[(Z)-[2,5-dimethyl-1-(2-propan-2-ylpyrazol-3-yl)pyrrol-3-yl]methylideneamino]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[(Z)-[1-(2-isopropylpyrazol-3-yl)-2,5-dimethyl-pyrrol-3-yl]methyleneamino]-1,3-benzodioxole-5-carboxamide CAS Name: N-[(Z)-[2,5-dimethyl-1-(2-propan-2-yl-3-pyrazolyl)-3-pyrrolyl]methylideneamino]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[(Z)-[2,5-dimethyl-1-(2-propan-2-ylpyrazol-3-yl)pyrrol-3-yl]methylideneamino]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[(Z)-[1-(2-isopropylpyrazol-3-yl)-2,5-dimethyl-pyrrol-3-yl]methyleneamino]-piperonylamide Formula: C21H23N5O3 MolecularWeight: 393.43902

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=NN2C(C)C)C)C=NNC(=O)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1=CC(=C(N1C2=CC=NN2C(C)C)C)/C=N\NC(=O)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C21H23N5O3/c1-13(2)26-20(7-8-23-26)25-14(3)9-17(15(25)4)11-22-24-21(27)16-5-6-18-19(10-16)29-12-28-18/h5-11,13H,12H2,1-4H3,(H,24,27)/b22-11-