1-(2-cyanoethanoylamino)-3-(4-ethanoylphenyl)thiourea

Systemtic Name: 1-(2-cyanoethanoylamino)-3-(4-ethanoylphenyl)thiourea Openeye Name: 1-(4-acetylphenyl)-3-[(2-cyanoacetyl)amino]thiourea CAS Name: 1-(4-acetylphenyl)-3-[(2-cyano-1-oxoethyl)amino]thiourea IUPAC Name: 1-(4-acetylphenyl)-3-[(2-cyanoacetyl)amino]thiourea Traditional Name: 1-(4-acetylphenyl)-3-[(2-cyanoacetyl)amino]thiourea Formula: C12H12N4O2S MolecularWeight: 276.31428

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H12N4O2S/c1-8(17)9-2-4-10(5-3-9)14-12(19)16-15-11(18)6-7-13/h2-5H,6H2,1H3,(H,15,18)(H2,14,16,19)