5-chloranyl-2-[[4-(N-ethyl-N-methyl-carbamimidoyl)phenyl]carbonylamino]-N-(5-ethynylpyridin-2-yl)benzamide

Systemtic Name: 5-chloranyl-2-[[4-(N-ethyl-N-methyl-carbamimidoyl)phenyl]carbonylamino]-N-(5-ethynylpyridin-2-yl)benzamide Openeye Name: 5-chloro-2-[[4-(N-ethyl-N-methyl-carbamimidoyl)benzoyl]amino]-N-(5-ethynyl-2-pyridyl)benzamide CAS Name: 5-chloro-2-[[[4-[[ethyl(methyl)amino]-iminomethyl]phenyl]-oxomethyl]amino]-N-(5-ethynyl-2-pyridinyl)benzamide IUPAC Name: 5-chloro-2-[[4-(N-ethyl-N-methylcarbamimidoyl)benzoyl]amino]-N-(5-ethynylpyridin-2-yl)benzamide Traditional Name: 5-chloro-2-[[4-(N-ethyl-N-methyl-amidino)benzoyl]amino]-N-(5-ethynyl-2-pyridyl)benzamide Formula: C25H22ClN5O2 MolecularWeight: 459.92748

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C)C(=N)C1=CC=C(C=C1)C(=O)NC2=C(C=C(C=C2)Cl)C(=O)NC3=NC=C(C=C3)C#C

Isomeric SMILES

CCN(C)C(=N)C1=CC=C(C=C1)C(=O)NC2=C(C=C(C=C2)Cl)C(=O)NC3=NC=C(C=C3)C#C

InChI

InChI=1S/C25H22ClN5O2/c1-4-16-6-13-22(28-15-16)30-25(33)20-14-19(26)11-12-21(20)29-24(32)18-9-7-17(8-10-18)23(27)31(3)5-2/h1,6-15,27H,5H2,2-3H3,(H,29,32)(H,28,30,33)