3-[2,5-bis(oxidanylidene)pyrrol-1-yl]-N-(5-methyl-6-oxidanylidene-6-thiophosphoroso-hexyl)propanamide

Systemtic Name: 3-[2,5-bis(oxidanylidene)pyrrol-1-yl]-N-(5-methyl-6-oxidanylidene-6-thiophosphoroso-hexyl)propanamide Openeye Name: 3-(2,5-dioxopyrrol-1-yl)-N-(5-methyl-6-oxo-6-thiophosphoroso-hexyl)propanamide CAS Name: 3-(2,5-dioxo-1-pyrrolyl)-N-(5-methyl-6-oxo-6-thiophosphorosohexyl)propanamide IUPAC Name: 3-(2,5-dioxopyrrol-1-yl)-N-(5-methyl-6-oxo-6-thiophosphorosohexyl)propanamide Traditional Name: N-(6-keto-5-methyl-6-thiophosphoroso-hexyl)-3-maleimido-propionamide Formula: C14H19N2O4PS MolecularWeight: 342.350421

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCCNC(=O)CCN1C(=O)C=CC1=O)C(=O)P=S

Isomeric SMILES

CC(CCCCNC(=O)CCN1C(=O)C=CC1=O)C(=O)P=S

InChI

InChI=1S/C14H19N2O4PS/c1-10(14(20)21-22)4-2-3-8-15-11(17)7-9-16-12(18)5-6-13(16)19/h5-6,10H,2-4,7-9H2,1H3,(H,15,17)