[3-(5-hexylsulfonyl-1,3,4-thiadiazol-2-yl)-1-methyl-2-oxidanylidene-1,3-diazinan-4-yl] N-(2-methoxyphenyl)carbamate

Systemtic Name: [3-(5-hexylsulfonyl-1,3,4-thiadiazol-2-yl)-1-methyl-2-oxidanylidene-1,3-diazinan-4-yl] N-(2-methoxyphenyl)carbamate Openeye Name: [3-(5-hexylsulfonyl-1,3,4-thiadiazol-2-yl)-1-methyl-2-oxo-hexahydropyrimidin-4-yl] N-(2-methoxyphenyl)carbamate CAS Name: N-(2-methoxyphenyl)carbamic acid [3-(5-hexylsulfonyl-1,3,4-thiadiazol-2-yl)-1-methyl-2-oxo-1,3-diazinan-4-yl] ester IUPAC Name: [3-(5-hexylsulfonyl-1,3,4-thiadiazol-2-yl)-1-methyl-2-oxo-1,3-diazinan-4-yl] N-(2-methoxyphenyl)carbamate Traditional Name: N-(2-methoxyphenyl)carbamic acid [3-(5-hexylsulfonyl-1,3,4-thiadiazol-2-yl)-2-keto-1-methyl-hexahydropyrimidin-4-yl] ester Formula: C21H29N5O6S2 MolecularWeight: 511.61486

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCS(=O)(=O)C1=NN=C(S1)N2C(CCN(C2=O)C)OC(=O)NC3=CC=CC=C3OC

Isomeric SMILES

CCCCCCS(=O)(=O)C1=NN=C(S1)N2C(CCN(C2=O)C)OC(=O)NC3=CC=CC=C3OC

InChI

InChI=1S/C21H29N5O6S2/c1-4-5-6-9-14-34(29,30)20-24-23-18(33-20)26-17(12-13-25(2)21(26)28)32-19(27)22-15-10-7-8-11-16(15)31-3/h7-8,10-11,17H,4-6,9,12-14H2,1-3H3,(H,22,27)