propan-2-yl 4-(4-ethylphenyl)-2-(pyrazin-2-ylcarbonylamino)thiophene-3-carboxylate

Systemtic Name: propan-2-yl 4-(4-ethylphenyl)-2-(pyrazin-2-ylcarbonylamino)thiophene-3-carboxylate Openeye Name: isopropyl 4-(4-ethylphenyl)-2-(pyrazine-2-carbonylamino)thiophene-3-carboxylate CAS Name: 4-(4-ethylphenyl)-2-[[oxo(2-pyrazinyl)methyl]amino]-3-thiophenecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-(4-ethylphenyl)-2-(pyrazine-2-carbonylamino)thiophene-3-carboxylate Traditional Name: 4-(4-ethylphenyl)-2-(pyrazinoylamino)thiophene-3-carboxylic acid isopropyl ester Formula: C21H21N3O3S MolecularWeight: 395.47474

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=CSC(=C2C(=O)OC(C)C)NC(=O)C3=NC=CN=C3

Isomeric SMILES

CCC1=CC=C(C=C1)C2=CSC(=C2C(=O)OC(C)C)NC(=O)C3=NC=CN=C3

InChI

InChI=1S/C21H21N3O3S/c1-4-14-5-7-15(8-6-14)16-12-28-20(18(16)21(26)27-13(2)3)24-19(25)17-11-22-9-10-23-17/h5-13H,4H2,1-3H3,(H,24,25)