methyl 2-[2,5-bis(oxidanylidene)-4-(3-thiocyanatopropyl)imidazolidin-1-yl]ethanoate

Systemtic Name: methyl 2-[2,5-bis(oxidanylidene)-4-(3-thiocyanatopropyl)imidazolidin-1-yl]ethanoate Openeye Name: methyl 2-[2,5-dioxo-4-(3-thiocyanatopropyl)imidazolidin-1-yl]acetate CAS Name: 2-[2,5-dioxo-4-(3-thiocyanatopropyl)-1-imidazolidinyl]acetic acid methyl ester IUPAC Name: methyl 2-[2,5-dioxo-4-(3-thiocyanatopropyl)imidazolidin-1-yl]acetate Traditional Name: 2-[2,5-diketo-4-(3-thiocyanatopropyl)imidazolidin-1-yl]acetic acid methyl ester Formula: C10H13N3O4S MolecularWeight: 271.29292

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CN1C(=O)C(NC1=O)CCCSC#N

Isomeric SMILES

COC(=O)CN1C(=O)C(NC1=O)CCCSC#N

InChI

InChI=1S/C10H13N3O4S/c1-17-8(14)5-13-9(15)7(12-10(13)16)3-2-4-18-6-11/h7H,2-5H2,1H3,(H,12,16)