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

Systemtic Name: ethyl 4-azanyl-6-methyl-2-(naphthalen-2-ylsulfanylmethyl)furo[2,3-d]pyrimidine-5-carboxylate Openeye Name: ethyl 4-amino-6-methyl-2-(2-naphthylsulfanylmethyl)furo[2,3-d]pyrimidine-5-carboxylate CAS Name: 4-amino-6-methyl-2-[(2-naphthalenylthio)methyl]-5-furo[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-amino-6-methyl-2-(naphthalen-2-ylsulfanylmethyl)furo[2,3-d]pyrimidine-5-carboxylate Traditional Name: 4-amino-6-methyl-2-[(2-naphthylthio)methyl]furo[2,3-d]pyrimidine-5-carboxylic acid ethyl ester Formula: C21H19N3O3S MolecularWeight: 393.45886

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC2=NC(=NC(=C12)N)CSC3=CC4=CC=CC=C4C=C3)C

Isomeric SMILES

CCOC(=O)C1=C(OC2=NC(=NC(=C12)N)CSC3=CC4=CC=CC=C4C=C3)C

InChI

InChI=1S/C21H19N3O3S/c1-3-26-21(25)17-12(2)27-20-18(17)19(22)23-16(24-20)11-28-15-9-8-13-6-4-5-7-14(13)10-15/h4-10H,3,11H2,1-2H3,(H2,22,23,24)