[3-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-1-methyl-2-oxidanylidene-1,3-diazinan-4-yl] N-(4-iodophenyl)carbamate

Systemtic Name: [3-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-1-methyl-2-oxidanylidene-1,3-diazinan-4-yl] N-(4-iodophenyl)carbamate Openeye Name: [3-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-1-methyl-2-oxo-hexahydropyrimidin-4-yl] N-(4-iodophenyl)carbamate CAS Name: N-(4-iodophenyl)carbamic acid [3-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-1-methyl-2-oxo-1,3-diazinan-4-yl] ester IUPAC Name: [3-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-1-methyl-2-oxo-1,3-diazinan-4-yl] N-(4-iodophenyl)carbamate Traditional Name: N-(4-iodophenyl)carbamic acid [3-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-2-keto-1-methyl-hexahydropyrimidin-4-yl] ester Formula: C18H22IN5O3S MolecularWeight: 515.36845

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN=C(S1)N2C(CCN(C2=O)C)OC(=O)NC3=CC=C(C=C3)I

Isomeric SMILES

CC(C)(C)C1=NN=C(S1)N2C(CCN(C2=O)C)OC(=O)NC3=CC=C(C=C3)I

InChI

InChI=1S/C18H22IN5O3S/c1-18(2,3)14-21-22-15(28-14)24-13(9-10-23(4)17(24)26)27-16(25)20-12-7-5-11(19)6-8-12/h5-8,13H,9-10H2,1-4H3,(H,20,25)