tert-butyl N-[3-(furan-2-ylmethyl)-6-oxidanylidene-2-sulfanylidene-1,3-diazinan-1-yl]carbamate

Systemtic Name: tert-butyl N-[3-(furan-2-ylmethyl)-6-oxidanylidene-2-sulfanylidene-1,3-diazinan-1-yl]carbamate Openeye Name: tert-butyl N-[3-(2-furylmethyl)-6-oxo-2-thioxo-hexahydropyrimidin-1-yl]carbamate CAS Name: N-[3-(2-furanylmethyl)-6-oxo-2-sulfanylidene-1,3-diazinan-1-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[3-(furan-2-ylmethyl)-6-oxo-2-sulfanylidene-1,3-diazinan-1-yl]carbamate Traditional Name: N-[3-(2-furfuryl)-6-keto-2-thioxo-hexahydropyrimidin-1-yl]carbamic acid tert-butyl ester Formula: C14H19N3O4S MolecularWeight: 325.38336

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NN1C(=O)CCN(C1=S)CC2=CC=CO2

Isomeric SMILES

CC(C)(C)OC(=O)NN1C(=O)CCN(C1=S)CC2=CC=CO2

InChI

InChI=1S/C14H19N3O4S/c1-14(2,3)21-12(19)15-17-11(18)6-7-16(13(17)22)9-10-5-4-8-20-10/h4-5,8H,6-7,9H2,1-3H3,(H,15,19)