ethyl (E)-3-azanyl-2-[(Z)-2-[(E)-3-azanyl-1-ethoxy-1-oxidanylidene-but-2-en-2-yl]sulfanyl-1,2-dicyano-ethenyl]sulfanyl-but-2-enoate

Systemtic Name: ethyl (E)-3-azanyl-2-[(Z)-2-[(E)-3-azanyl-1-ethoxy-1-oxidanylidene-but-2-en-2-yl]sulfanyl-1,2-dicyano-ethenyl]sulfanyl-but-2-enoate Openeye Name: ethyl (E)-3-amino-2-[(Z)-2-[(E)-2-amino-1-ethoxycarbonyl-prop-1-enyl]sulfanyl-1,2-dicyano-vinyl]sulfanyl-but-2-enoate CAS Name: (E)-3-amino-2-[[(Z)-2-[[(E)-3-amino-1-ethoxy-1-oxobut-2-en-2-yl]thio]-1,2-dicyanoethenyl]thio]-2-butenoic acid ethyl ester IUPAC Name: ethyl (E)-3-amino-2-[(Z)-2-[(E)-3-amino-1-ethoxy-1-oxobut-2-en-2-yl]sulfanyl-1,2-dicyanoethenyl]sulfanylbut-2-enoate Traditional Name: (E)-3-amino-2-[[(Z)-2-[[(E)-2-amino-1-carbethoxy-prop-1-enyl]thio]-1,2-dicyano-vinyl]thio]but-2-enoic acid ethyl ester Formula: C16H20N4O4S2 MolecularWeight: 396.4844

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=C(C)N)SC(=C(C#N)SC(=C(C)N)C(=O)OCC)C#N

Isomeric SMILES

CCOC(=O)/C(=C(\N)/C)/S/C(=C(\S/C(=C(/N)\C)/C(=O)OCC)/C#N)/C#N

InChI

InChI=1S/C16H20N4O4S2/c1-5-23-15(21)13(9(3)19)25-11(7-17)12(8-18)26-14(10(4)20)16(22)24-6-2/h5-6,19-20H2,1-4H3/b12-11-,13-9+,14-10+