3-butyl-N-[(E)-(1-butyl-2-oxidanylidene-indol-3-ylidene)amino]-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: 3-butyl-N-[(E)-(1-butyl-2-oxidanylidene-indol-3-ylidene)amino]-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: 3-butyl-N-[(E)-(1-butyl-2-oxo-indolin-3-ylidene)amino]-4-oxo-phthalazine-1-carboxamide CAS Name: 3-butyl-N-[(E)-(1-butyl-2-oxo-3-indolylidene)amino]-4-oxo-1-phthalazinecarboxamide IUPAC Name: 3-butyl-N-[(E)-(1-butyl-2-oxoindol-3-ylidene)amino]-4-oxophthalazine-1-carboxamide Traditional Name: 3-butyl-N-[(E)-(1-butyl-2-keto-indolin-3-ylidene)amino]-4-keto-phthalazine-1-carboxamide Formula: C25H27N5O3 MolecularWeight: 445.51358

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=CC=CC=C2C(=NNC(=O)C3=NN(C(=O)C4=CC=CC=C43)CCCC)C1=O

Isomeric SMILES

CCCCN1C2=CC=CC=C2/C(=N\NC(=O)C3=NN(C(=O)C4=CC=CC=C43)CCCC)/C1=O

InChI

InChI=1S/C25H27N5O3/c1-3-5-15-29-20-14-10-9-13-19(20)22(25(29)33)26-27-23(31)21-17-11-7-8-12-18(17)24(32)30(28-21)16-6-4-2/h7-14H,3-6,15-16H2,1-2H3,(H,27,31)/b26-22+