N-[(E)-[5-chloranyl-3-methyl-1-(phenylmethyl)pyrazol-4-yl]methylideneamino]-3-ethyl-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: N-[(E)-[5-chloranyl-3-methyl-1-(phenylmethyl)pyrazol-4-yl]methylideneamino]-3-ethyl-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: N-[(E)-(1-benzyl-5-chloro-3-methyl-pyrazol-4-yl)methyleneamino]-3-ethyl-4-oxo-phthalazine-1-carboxamide CAS Name: N-[(E)-[5-chloro-3-methyl-1-(phenylmethyl)-4-pyrazolyl]methylideneamino]-3-ethyl-4-oxo-1-phthalazinecarboxamide IUPAC Name: N-[(E)-(1-benzyl-5-chloro-3-methylpyrazol-4-yl)methylideneamino]-3-ethyl-4-oxophthalazine-1-carboxamide Traditional Name: N-[(E)-(1-benzyl-5-chloro-3-methyl-pyrazol-4-yl)methyleneamino]-3-ethyl-4-keto-phthalazine-1-carboxamide Formula: C23H21ClN6O2 MolecularWeight: 448.90484

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NN=CC3=C(N(N=C3C)CC4=CC=CC=C4)Cl

Isomeric SMILES

CCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N/N=C/C3=C(N(N=C3C)CC4=CC=CC=C4)Cl

InChI

InChI=1S/C23H21ClN6O2/c1-3-29-23(32)18-12-8-7-11-17(18)20(28-29)22(31)26-25-13-19-15(2)27-30(21(19)24)14-16-9-5-4-6-10-16/h4-13H,3,14H2,1-2H3,(H,26,31)/b25-13+