ethyl 4-azanyl-2-[1-[5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]ethylsulfanyl]pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-azanyl-2-[1-[5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]ethylsulfanyl]pyrimidine-5-carboxylate Openeye Name: ethyl 4-amino-2-[1-[5-(m-tolyl)-1,3,4-oxadiazol-2-yl]ethylsulfanyl]pyrimidine-5-carboxylate CAS Name: 4-amino-2-[1-[5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]ethylthio]-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-amino-2-[1-[5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]ethylsulfanyl]pyrimidine-5-carboxylate Traditional Name: 4-amino-2-[1-[5-(m-tolyl)-1,3,4-oxadiazol-2-yl]ethylthio]pyrimidine-5-carboxylic acid ethyl ester Formula: C18H19N5O3S MolecularWeight: 385.44016

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(N=C1N)SC(C)C2=NN=C(O2)C3=CC(=CC=C3)C

Isomeric SMILES

CCOC(=O)C1=CN=C(N=C1N)SC(C)C2=NN=C(O2)C3=CC(=CC=C3)C

InChI

InChI=1S/C18H19N5O3S/c1-4-25-17(24)13-9-20-18(21-14(13)19)27-11(3)15-22-23-16(26-15)12-7-5-6-10(2)8-12/h5-9,11H,4H2,1-3H3,(H2,19,20,21)