ethyl 5-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-[(5-methylpyrazin-2-yl)carbonylamino]thiophene-2-carboxylate

Systemtic Name: ethyl 5-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-[(5-methylpyrazin-2-yl)carbonylamino]thiophene-2-carboxylate Openeye Name: ethyl 5-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-[(5-methylpyrazine-2-carbonyl)amino]thiophene-2-carboxylate CAS Name: 5-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-[[(5-methyl-2-pyrazinyl)-oxomethyl]amino]-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-[(5-methylpyrazine-2-carbonyl)amino]thiophene-2-carboxylate Traditional Name: 5-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-[(5-methylpyrazinoyl)amino]thiophene-2-carboxylic acid ethyl ester Formula: C21H19N3O5S MolecularWeight: 425.45766

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=C(S1)C2=CC3=C(C=C2)OCCO3)NC(=O)C4=CN=C(C=N4)C

Isomeric SMILES

CCOC(=O)C1=C(C=C(S1)C2=CC3=C(C=C2)OCCO3)NC(=O)C4=CN=C(C=N4)C

InChI

InChI=1S/C21H19N3O5S/c1-3-27-21(26)19-14(24-20(25)15-11-22-12(2)10-23-15)9-18(30-19)13-4-5-16-17(8-13)29-7-6-28-16/h4-5,8-11H,3,6-7H2,1-2H3,(H,24,25)