1-[(E)-(2,2-dimethyl-4-oxidanidyl-1-oxidanyl-3-thiophen-2-yl-1-aza-4-azoniaspiro[4.5]dec-3-en-10-ylidene)amino]urea

Systemtic Name: 1-[(E)-(2,2-dimethyl-4-oxidanidyl-1-oxidanyl-3-thiophen-2-yl-1-aza-4-azoniaspiro[4.5]dec-3-en-10-ylidene)amino]urea Openeye Name: [(E)-[1-hydroxy-2,2-dimethyl-4-oxido-3-(2-thienyl)-1-aza-4-azoniaspiro[4.5]dec-3-en-10-ylidene]amino]urea CAS Name: [(E)-(1-hydroxy-2,2-dimethyl-4-oxido-3-thiophen-2-yl-1-aza-4-azoniaspiro[4.5]dec-3-en-10-ylidene)amino]urea IUPAC Name: [(E)-(1-hydroxy-2,2-dimethyl-4-oxido-3-thiophen-2-yl-1-aza-4-azoniaspiro[4.5]dec-3-en-10-ylidene)amino]urea Traditional Name: [(E)-[1-hydroxy-2,2-dimethyl-4-oxido-3-(2-thienyl)-1-aza-4-azoniaspiro[4.5]dec-3-en-10-ylidene]amino]urea Formula: C15H21N5O3S MolecularWeight: 351.42394

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=[N+](C2(N1O)CCCCC2=NNC(=O)N)[O-])C3=CC=CS3)C

Isomeric SMILES

CC1(C(=[N+](C\2(N1O)CCCC/C2=N\NC(=O)N)[O-])C3=CC=CS3)C

InChI

InChI=1S/C15H21N5O3S/c1-14(2)12(10-6-5-9-24-10)19(22)15(20(14)23)8-4-3-7-11(15)17-18-13(16)21/h5-6,9,23H,3-4,7-8H2,1-2H3,(H3,16,18,21)/b17-11+