(E)-2-cyano-1-ethoxy-3-[2-(2-phenylethanoyl)hydrazinyl]-3-sulfanylidene-prop-1-en-1-olate; (2-phenylethanoylamino)azanium

Systemtic Name: (E)-2-cyano-1-ethoxy-3-[2-(2-phenylethanoyl)hydrazinyl]-3-sulfanylidene-prop-1-en-1-olate; (2-phenylethanoylamino)azanium Openeye Name: (E)-2-cyano-1-ethoxy-3-[2-(2-phenylacetyl)hydrazino]-3-thioxo-prop-1-en-1-olate; [(2-phenylacetyl)amino]ammonium CAS Name: (E)-2-cyano-1-ethoxy-3-[(1-oxo-2-phenylethyl)hydrazo]-3-sulfanylidene-1-propen-1-olate; [(1-oxo-2-phenylethyl)amino]ammonium IUPAC Name: (E)-2-cyano-1-ethoxy-3-[2-(2-phenylacetyl)hydrazinyl]-3-sulfanylideneprop-1-en-1-olate; [(2-phenylacetyl)amino]azanium Traditional Name: (E)-2-cyano-1-ethoxy-3-[N'-(2-phenylacetyl)hydrazino]-3-thioxo-prop-1-en-1-olate; [(2-phenylacetyl)amino]ammonium Formula: C22H25N5O4S MolecularWeight: 455.53

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=C(C#N)C(=S)NNC(=O)CC1=CC=CC=C1)[O-].C1=CC=C(C=C1)CC(=O)N[NH3+]

Isomeric SMILES

CCO/C(=C(\C#N)/C(=S)NNC(=O)CC1=CC=CC=C1)/[O-].C1=CC=C(C=C1)CC(=O)N[NH3+]

InChI

InChI=1S/C14H15N3O3S.C8H10N2O/c1-2-20-14(19)11(9-15)13(21)17-16-12(18)8-10-6-4-3-5-7-10;9-10-8(11)6-7-4-2-1-3-5-7/h3-7,19H,2,8H2,1H3,(H,16,18)(H,17,21);1-5H,6,9H2,(H,10,11)/b14-11+;