prop-2-enyl N'-methyl-N-[(E)-(5-nitrofuran-2-yl)methylideneamino]carbamimidothioate

Systemtic Name: prop-2-enyl N'-methyl-N-[(E)-(5-nitrofuran-2-yl)methylideneamino]carbamimidothioate Openeye Name: 2-allyl-3-methyl-1-[(E)-(5-nitro-2-furyl)methyleneamino]isothiourea CAS Name: N'-methyl-N-[(E)-(5-nitro-2-furanyl)methylideneamino]carbamimidothioic acid prop-2-enyl ester IUPAC Name: prop-2-enyl N'-methyl-N-[(E)-(5-nitrofuran-2-yl)methylideneamino]carbamimidothioate Traditional Name: 2-allyl-3-methyl-1-[(E)-(5-nitro-2-furyl)methyleneamino]isothiourea Formula: C10H12N4O3S MolecularWeight: 268.29228

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Descriptors Computed from Structure

Canonical SMILES:

CN=C(NN=CC1=CC=C(O1)[N+](=O)[O-])SCC=C

Isomeric SMILES

CN=C(N/N=C/C1=CC=C(O1)[N+](=O)[O-])SCC=C

InChI

InChI=1S/C10H12N4O3S/c1-3-6-18-10(11-2)13-12-7-8-4-5-9(17-8)14(15)16/h3-5,7H,1,6H2,2H3,(H,11,13)/b12-7+