1-[[(E)-1-[(4-ethoxyphenyl)amino]-1-nitroso-prop-1-en-2-yl]amino]thiourea

Systemtic Name: 1-[[(E)-1-[(4-ethoxyphenyl)amino]-1-nitroso-prop-1-en-2-yl]amino]thiourea Openeye Name: [[(E)-2-(4-ethoxyanilino)-1-methyl-2-nitroso-vinyl]amino]thiourea CAS Name: [[(E)-1-(4-ethoxyanilino)-1-nitrosoprop-1-en-2-yl]amino]thiourea IUPAC Name: [[(E)-1-(4-ethoxyanilino)-1-nitrosoprop-1-en-2-yl]amino]thiourea Traditional Name: [[(E)-1-methyl-2-nitroso-2-(p-phenetidino)vinyl]amino]thiourea Formula: C12H17N5O2S MolecularWeight: 295.36068

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=C(C)NNC(=S)N)N=O

Isomeric SMILES

CCOC1=CC=C(C=C1)N/C(=C(/C)\NNC(=S)N)/N=O

InChI

InChI=1S/C12H17N5O2S/c1-3-19-10-6-4-9(5-7-10)14-11(17-18)8(2)15-16-12(13)20/h4-7,14-15H,3H2,1-2H3,(H3,13,16,20)/b11-8+