[2-[[4-(3,4-dimethoxyphenyl)-3-ethoxycarbonyl-thiophen-2-yl]amino]-2-oxidanylidene-ethyl] 3-azanylpyrazine-2-carboxylate

Systemtic Name: [2-[[4-(3,4-dimethoxyphenyl)-3-ethoxycarbonyl-thiophen-2-yl]amino]-2-oxidanylidene-ethyl] 3-azanylpyrazine-2-carboxylate Openeye Name: [2-[[4-(3,4-dimethoxyphenyl)-3-ethoxycarbonyl-2-thienyl]amino]-2-oxo-ethyl] 3-aminopyrazine-2-carboxylate CAS Name: 3-amino-2-pyrazinecarboxylic acid [2-[[4-(3,4-dimethoxyphenyl)-3-ethoxycarbonyl-2-thiophenyl]amino]-2-oxoethyl] ester IUPAC Name: [2-[[4-(3,4-dimethoxyphenyl)-3-ethoxycarbonylthiophen-2-yl]amino]-2-oxoethyl] 3-aminopyrazine-2-carboxylate Traditional Name: 3-aminopyrazinic acid [2-[[3-carbethoxy-4-(3,4-dimethoxyphenyl)-2-thienyl]amino]-2-keto-ethyl] ester Formula: C22H22N4O7S MolecularWeight: 486.49768

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC(=C(C=C2)OC)OC)NC(=O)COC(=O)C3=NC=CN=C3N

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC(=C(C=C2)OC)OC)NC(=O)COC(=O)C3=NC=CN=C3N

InChI

InChI=1S/C22H22N4O7S/c1-4-32-21(28)17-13(12-5-6-14(30-2)15(9-12)31-3)11-34-20(17)26-16(27)10-33-22(29)18-19(23)25-8-7-24-18/h5-9,11H,4,10H2,1-3H3,(H2,23,25)(H,26,27)