[3-(5-hexylsulfanyl-1,3,4-thiadiazol-2-yl)-1-methyl-2-oxidanylidene-1,3-diazinan-4-yl] cyclopentylsulfanylmethanoate

Systemtic Name: [3-(5-hexylsulfanyl-1,3,4-thiadiazol-2-yl)-1-methyl-2-oxidanylidene-1,3-diazinan-4-yl] cyclopentylsulfanylmethanoate Openeye Name: [3-(5-hexylsulfanyl-1,3,4-thiadiazol-2-yl)-1-methyl-2-oxo-hexahydropyrimidin-4-yl] cyclopentylsulfanylformate CAS Name: (cyclopentylthio)formic acid [3-[5-(hexylthio)-1,3,4-thiadiazol-2-yl]-1-methyl-2-oxo-1,3-diazinan-4-yl] ester IUPAC Name: [3-(5-hexylsulfanyl-1,3,4-thiadiazol-2-yl)-1-methyl-2-oxo-1,3-diazinan-4-yl] cyclopentylsulfanylformate Traditional Name: (cyclopentylthio)formic acid [3-[5-(hexylthio)-1,3,4-thiadiazol-2-yl]-2-keto-1-methyl-hexahydropyrimidin-4-yl] ester Formula: C19H30N4O3S3 MolecularWeight: 458.6615

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCSC1=NN=C(S1)N2C(CCN(C2=O)C)OC(=O)SC3CCCC3

Isomeric SMILES

CCCCCCSC1=NN=C(S1)N2C(CCN(C2=O)C)OC(=O)SC3CCCC3

InChI

InChI=1S/C19H30N4O3S3/c1-3-4-5-8-13-27-17-21-20-16(29-17)23-15(11-12-22(2)18(23)24)26-19(25)28-14-9-6-7-10-14/h14-15H,3-13H2,1-2H3