[1-hexyl-3-(5-hexyl-1,3,4-thiadiazol-2-yl)-2-oxidanylidene-1,3-diazinan-4-yl] N-butyl-N-phenyl-carbamate

Systemtic Name: [1-hexyl-3-(5-hexyl-1,3,4-thiadiazol-2-yl)-2-oxidanylidene-1,3-diazinan-4-yl] N-butyl-N-phenyl-carbamate Openeye Name: [1-hexyl-3-(5-hexyl-1,3,4-thiadiazol-2-yl)-2-oxo-hexahydropyrimidin-4-yl] N-butyl-N-phenyl-carbamate CAS Name: N-butyl-N-phenylcarbamic acid [1-hexyl-3-(5-hexyl-1,3,4-thiadiazol-2-yl)-2-oxo-1,3-diazinan-4-yl] ester IUPAC Name: [1-hexyl-3-(5-hexyl-1,3,4-thiadiazol-2-yl)-2-oxo-1,3-diazinan-4-yl] N-butyl-N-phenylcarbamate Traditional Name: N-butyl-N-phenyl-carbamic acid [1-hexyl-3-(5-hexyl-1,3,4-thiadiazol-2-yl)-2-keto-hexahydropyrimidin-4-yl] ester Formula: C29H45N5O3S MolecularWeight: 543.7643

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=NN=C(S1)N2C(CCN(C2=O)CCCCCC)OC(=O)N(CCCC)C3=CC=CC=C3

Isomeric SMILES

CCCCCCC1=NN=C(S1)N2C(CCN(C2=O)CCCCCC)OC(=O)N(CCCC)C3=CC=CC=C3

InChI

InChI=1S/C29H45N5O3S/c1-4-7-10-15-19-25-30-31-27(38-25)34-26(20-23-32(28(34)35)21-16-11-8-5-2)37-29(36)33(22-9-6-3)24-17-13-12-14-18-24/h12-14,17-18,26H,4-11,15-16,19-23H2,1-3H3