2-[[3-cyano-5-methyl-4-[(4-phenoxyphenyl)amino]pyrrolo[1,2-b]pyridazin-6-yl]carbamoylamino]ethanamide

Systemtic Name: 2-[[3-cyano-5-methyl-4-[(4-phenoxyphenyl)amino]pyrrolo[1,2-b]pyridazin-6-yl]carbamoylamino]ethanamide Openeye Name: 2-[[3-cyano-5-methyl-4-(4-phenoxyanilino)pyrrolo[1,2-b]pyridazin-6-yl]carbamoylamino]acetamide CAS Name: 2-[[[[3-cyano-5-methyl-4-(4-phenoxyanilino)-6-pyrrolo[1,2-b]pyridazinyl]amino]-oxomethyl]amino]acetamide IUPAC Name: 2-[[3-cyano-5-methyl-4-(4-phenoxyanilino)pyrrolo[1,2-b]pyridazin-6-yl]carbamoylamino]acetamide Traditional Name: 2-[[3-cyano-5-methyl-4-(4-phenoxyanilino)pyrrolo[1,2-b]pyridazin-6-yl]carbamoylamino]acetamide Formula: C24H21N7O3 MolecularWeight: 455.46864

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C=NN2C=C1NC(=O)NCC(=O)N)C#N)NC3=CC=C(C=C3)OC4=CC=CC=C4

Isomeric SMILES

CC1=C2C(=C(C=NN2C=C1NC(=O)NCC(=O)N)C#N)NC3=CC=C(C=C3)OC4=CC=CC=C4

InChI

InChI=1S/C24H21N7O3/c1-15-20(30-24(33)27-13-21(26)32)14-31-23(15)22(16(11-25)12-28-31)29-17-7-9-19(10-8-17)34-18-5-3-2-4-6-18/h2-10,12,14,29H,13H2,1H3,(H2,26,32)(H2,27,30,33)