[(E)-4-(tert-butylamino)-4-oxidanylidene-but-2-en-2-yl] 3-azanyl-6-chloranyl-5-(ethylamino)pyrazine-2-carboxylate

Systemtic Name: [(E)-4-(tert-butylamino)-4-oxidanylidene-but-2-en-2-yl] 3-azanyl-6-chloranyl-5-(ethylamino)pyrazine-2-carboxylate Openeye Name: [(E)-3-(tert-butylamino)-1-methyl-3-oxo-prop-1-enyl] 3-amino-6-chloro-5-(ethylamino)pyrazine-2-carboxylate CAS Name: 3-amino-6-chloro-5-(ethylamino)-2-pyrazinecarboxylic acid [(E)-4-(tert-butylamino)-4-oxobut-2-en-2-yl] ester IUPAC Name: [(E)-4-(tert-butylamino)-4-oxobut-2-en-2-yl] 3-amino-6-chloro-5-(ethylamino)pyrazine-2-carboxylate Traditional Name: 3-amino-6-chloro-5-(ethylamino)pyrazinic acid [(E)-3-(tert-butylamino)-3-keto-1-methyl-prop-1-enyl] ester Formula: C15H22ClN5O3 MolecularWeight: 355.81988

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCNC1=NC(=C(N=C1Cl)C(=O)OC(=CC(=O)NC(C)(C)C)C)N

Isomeric SMILES

CCNC1=NC(=C(N=C1Cl)C(=O)O/C(=C/C(=O)NC(C)(C)C)/C)N

InChI

InChI=1S/C15H22ClN5O3/c1-6-18-13-11(16)19-10(12(17)20-13)14(23)24-8(2)7-9(22)21-15(3,4)5/h7H,6H2,1-5H3,(H,21,22)(H3,17,18,20)/b8-7+