ethyl N-(2-cyano-3-methyl-phenyl)sulfonyl-N'-propan-2-yl-carbamimidate

Systemtic Name: ethyl N-(2-cyano-3-methyl-phenyl)sulfonyl-N'-propan-2-yl-carbamimidate Openeye Name: 1-(2-cyano-3-methyl-phenyl)sulfonyl-2-ethyl-3-isopropyl-isourea CAS Name: N-(2-cyano-3-methylphenyl)sulfonyl-N'-propan-2-ylcarbamimidic acid ethyl ester IUPAC Name: ethyl N-(2-cyano-3-methylphenyl)sulfonyl-N'-propan-2-ylcarbamimidate Traditional Name: 1-(2-cyano-3-methyl-phenyl)sulfonyl-2-ethyl-3-isopropyl-isourea Formula: C14H19N3O3S MolecularWeight: 309.38396

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=NC(C)C)NS(=O)(=O)C1=CC=CC(=C1C#N)C

Isomeric SMILES

CCOC(=NC(C)C)NS(=O)(=O)C1=CC=CC(=C1C#N)C

InChI

InChI=1S/C14H19N3O3S/c1-5-20-14(16-10(2)3)17-21(18,19)13-8-6-7-11(4)12(13)9-15/h6-8,10H,5H2,1-4H3,(H,16,17)