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

Systemtic Name: [3-(5-cycloheptyl-1,3,4-thiadiazol-2-yl)-1-methyl-2-oxidanylidene-1,3-diazinan-4-yl] cycloheptanecarboxylate Openeye Name: [3-(5-cycloheptyl-1,3,4-thiadiazol-2-yl)-1-methyl-2-oxo-hexahydropyrimidin-4-yl] cycloheptanecarboxylate CAS Name: cycloheptanecarboxylic acid [3-(5-cycloheptyl-1,3,4-thiadiazol-2-yl)-1-methyl-2-oxo-1,3-diazinan-4-yl] ester IUPAC Name: [3-(5-cycloheptyl-1,3,4-thiadiazol-2-yl)-1-methyl-2-oxo-1,3-diazinan-4-yl] cycloheptanecarboxylate Traditional Name: cycloheptanecarboxylic acid [3-(5-cycloheptyl-1,3,4-thiadiazol-2-yl)-2-keto-1-methyl-hexahydropyrimidin-4-yl] ester Formula: C22H34N4O3S MolecularWeight: 434.59536

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(N(C1=O)C2=NN=C(S2)C3CCCCCC3)OC(=O)C4CCCCCC4

Isomeric SMILES

CN1CCC(N(C1=O)C2=NN=C(S2)C3CCCCCC3)OC(=O)C4CCCCCC4

InChI

InChI=1S/C22H34N4O3S/c1-25-15-14-18(29-20(27)17-12-8-4-5-9-13-17)26(22(25)28)21-24-23-19(30-21)16-10-6-2-3-7-11-16/h16-18H,2-15H2,1H3