1-methyl-N-(3-nitrophenyl)-3-oxidanidyl-3-(5-prop-2-enyl-1,3,4-thiadiazol-2-yl)imidazolidin-3-ium-4-amine

Systemtic Name: 1-methyl-N-(3-nitrophenyl)-3-oxidanidyl-3-(5-prop-2-enyl-1,3,4-thiadiazol-2-yl)imidazolidin-3-ium-4-amine Openeye Name: 3-(5-allyl-1,3,4-thiadiazol-2-yl)-1-methyl-N-(3-nitrophenyl)-3-oxido-imidazolidin-3-ium-4-amine CAS Name: 1-methyl-N-(3-nitrophenyl)-3-oxido-3-(5-prop-2-enyl-1,3,4-thiadiazol-2-yl)-4-imidazolidin-3-iumamine IUPAC Name: 1-methyl-N-(3-nitrophenyl)-3-oxido-3-(5-prop-2-enyl-1,3,4-thiadiazol-2-yl)imidazolidin-3-ium-4-amine Traditional Name: [3-(5-allyl-1,3,4-thiadiazol-2-yl)-1-methyl-3-oxido-imidazolidin-3-ium-4-yl]-(3-nitrophenyl)amine Formula: C15H18N6O3S MolecularWeight: 362.40682

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Descriptors Computed from Structure

Canonical SMILES:

CN1CC([N+](C1)(C2=NN=C(S2)CC=C)[O-])NC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CN1CC([N+](C1)(C2=NN=C(S2)CC=C)[O-])NC3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C15H18N6O3S/c1-3-5-14-17-18-15(25-14)21(24)10-19(2)9-13(21)16-11-6-4-7-12(8-11)20(22)23/h3-4,6-8,13,16H,1,5,9-10H2,2H3