ethyl 4-azanyl-6-methyl-2-[(4-methyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanylmethyl]furo[2,3-d]pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-azanyl-6-methyl-2-[(4-methyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanylmethyl]furo[2,3-d]pyrimidine-5-carboxylate Openeye Name: ethyl 4-amino-6-methyl-2-[[4-methyl-5-(2-thienyl)-1,2,4-triazol-3-yl]sulfanylmethyl]furo[2,3-d]pyrimidine-5-carboxylate CAS Name: 4-amino-6-methyl-2-[[(4-methyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)thio]methyl]-5-furo[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-amino-6-methyl-2-[(4-methyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanylmethyl]furo[2,3-d]pyrimidine-5-carboxylate Traditional Name: 4-amino-6-methyl-2-[[[4-methyl-5-(2-thienyl)-1,2,4-triazol-3-yl]thio]methyl]furo[2,3-d]pyrimidine-5-carboxylic acid ethyl ester Formula: C18H18N6O3S2 MolecularWeight: 430.50392

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC2=NC(=NC(=C12)N)CSC3=NN=C(N3C)C4=CC=CS4)C

Isomeric SMILES

CCOC(=O)C1=C(OC2=NC(=NC(=C12)N)CSC3=NN=C(N3C)C4=CC=CS4)C

InChI

InChI=1S/C18H18N6O3S2/c1-4-26-17(25)12-9(2)27-16-13(12)14(19)20-11(21-16)8-29-18-23-22-15(24(18)3)10-6-5-7-28-10/h5-7H,4,8H2,1-3H3,(H2,19,20,21)