ethyl 4-azanyl-2-(1,3-benzothiazol-2-ylsulfanylmethyl)-6-methyl-furo[2,3-d]pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-azanyl-2-(1,3-benzothiazol-2-ylsulfanylmethyl)-6-methyl-furo[2,3-d]pyrimidine-5-carboxylate Openeye Name: ethyl 4-amino-2-(1,3-benzothiazol-2-ylsulfanylmethyl)-6-methyl-furo[2,3-d]pyrimidine-5-carboxylate CAS Name: 4-amino-2-[(1,3-benzothiazol-2-ylthio)methyl]-6-methyl-5-furo[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-amino-2-(1,3-benzothiazol-2-ylsulfanylmethyl)-6-methylfuro[2,3-d]pyrimidine-5-carboxylate Traditional Name: 4-amino-2-[(1,3-benzothiazol-2-ylthio)methyl]-6-methyl-furo[2,3-d]pyrimidine-5-carboxylic acid ethyl ester Formula: C18H16N4O3S2 MolecularWeight: 400.47464

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC2=NC(=NC(=C12)N)CSC3=NC4=CC=CC=C4S3)C

Isomeric SMILES

CCOC(=O)C1=C(OC2=NC(=NC(=C12)N)CSC3=NC4=CC=CC=C4S3)C

InChI

InChI=1S/C18H16N4O3S2/c1-3-24-17(23)13-9(2)25-16-14(13)15(19)21-12(22-16)8-26-18-20-10-6-4-5-7-11(10)27-18/h4-7H,3,8H2,1-2H3,(H2,19,21,22)