ethyl 4-azanyl-2-[(3-chloranyl-1-benzothiophen-2-yl)carbonyloxymethyl]-6-methyl-furo[2,3-d]pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-azanyl-2-[(3-chloranyl-1-benzothiophen-2-yl)carbonyloxymethyl]-6-methyl-furo[2,3-d]pyrimidine-5-carboxylate Openeye Name: ethyl 4-amino-2-[(3-chlorobenzothiophene-2-carbonyl)oxymethyl]-6-methyl-furo[2,3-d]pyrimidine-5-carboxylate CAS Name: 4-amino-2-[[(3-chloro-1-benzothiophen-2-yl)-oxomethoxy]methyl]-6-methyl-5-furo[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-amino-2-[(3-chloro-1-benzothiophene-2-carbonyl)oxymethyl]-6-methylfuro[2,3-d]pyrimidine-5-carboxylate Traditional Name: 4-amino-2-[(3-chlorobenzothiophene-2-carbonyl)oxymethyl]-6-methyl-furo[2,3-d]pyrimidine-5-carboxylic acid ethyl ester Formula: C20H16ClN3O5S MolecularWeight: 445.87614

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC2=NC(=NC(=C12)N)COC(=O)C3=C(C4=CC=CC=C4S3)Cl)C

Isomeric SMILES

CCOC(=O)C1=C(OC2=NC(=NC(=C12)N)COC(=O)C3=C(C4=CC=CC=C4S3)Cl)C

InChI

InChI=1S/C20H16ClN3O5S/c1-3-27-19(25)13-9(2)29-18-14(13)17(22)23-12(24-18)8-28-20(26)16-15(21)10-6-4-5-7-11(10)30-16/h4-7H,3,8H2,1-2H3,(H2,22,23,24)