methyl 4-[2-(ethylcarbamoylamino)-4-fluoranyl-7-pyridin-2-yl-1,3-benzothiazol-5-yl]thiophene-2-carboxylate

Systemtic Name: methyl 4-[2-(ethylcarbamoylamino)-4-fluoranyl-7-pyridin-2-yl-1,3-benzothiazol-5-yl]thiophene-2-carboxylate Openeye Name: methyl 4-[2-(ethylcarbamoylamino)-4-fluoro-7-(2-pyridyl)-1,3-benzothiazol-5-yl]thiophene-2-carboxylate CAS Name: 4-[2-(ethylcarbamoylamino)-4-fluoro-7-(2-pyridinyl)-1,3-benzothiazol-5-yl]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4-[2-(ethylcarbamoylamino)-4-fluoro-7-pyridin-2-yl-1,3-benzothiazol-5-yl]thiophene-2-carboxylate Traditional Name: 4-[2-(ethylcarbamoylamino)-4-fluoro-7-(2-pyridyl)-1,3-benzothiazol-5-yl]thiophene-2-carboxylic acid methyl ester Formula: C21H17FN4O3S2 MolecularWeight: 456.513083

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)NC1=NC2=C(C(=CC(=C2S1)C3=CC=CC=N3)C4=CSC(=C4)C(=O)OC)F

Isomeric SMILES

CCNC(=O)NC1=NC2=C(C(=CC(=C2S1)C3=CC=CC=N3)C4=CSC(=C4)C(=O)OC)F

InChI

InChI=1S/C21H17FN4O3S2/c1-3-23-20(28)26-21-25-17-16(22)12(11-8-15(30-10-11)19(27)29-2)9-13(18(17)31-21)14-6-4-5-7-24-14/h4-10H,3H2,1-2H3,(H2,23,25,26,28)