[1-butyl-3-oxidanidyl-3-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)imidazolidin-3-ium-4-yl] N-propylcarbamate

Systemtic Name: [1-butyl-3-oxidanidyl-3-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)imidazolidin-3-ium-4-yl] N-propylcarbamate Openeye Name: [1-butyl-3-(5-isopropyl-1,3,4-thiadiazol-2-yl)-3-oxido-imidazolidin-3-ium-4-yl] N-propylcarbamate CAS Name: N-propylcarbamic acid [1-butyl-3-oxido-3-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)-4-imidazolidin-3-iumyl] ester IUPAC Name: [1-butyl-3-oxido-3-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)imidazolidin-3-ium-4-yl] N-propylcarbamate Traditional Name: N-propylcarbamic acid [1-butyl-3-(5-isopropyl-1,3,4-thiadiazol-2-yl)-3-oxido-imidazolidin-3-ium-4-yl] ester Formula: C16H29N5O3S MolecularWeight: 371.49816

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1CC([N+](C1)(C2=NN=C(S2)C(C)C)[O-])OC(=O)NCCC

Isomeric SMILES

CCCCN1CC([N+](C1)(C2=NN=C(S2)C(C)C)[O-])OC(=O)NCCC

InChI

InChI=1S/C16H29N5O3S/c1-5-7-9-20-10-13(24-16(22)17-8-6-2)21(23,11-20)15-19-18-14(25-15)12(3)4/h12-13H,5-11H2,1-4H3,(H,17,22)