methyl 2-[(6-methyl-4-piperidin-1-yl-furo[2,3-d]pyrimidin-5-yl)carbonylamino]-4-methylsulfanyl-butanoate

Systemtic Name: methyl 2-[(6-methyl-4-piperidin-1-yl-furo[2,3-d]pyrimidin-5-yl)carbonylamino]-4-methylsulfanyl-butanoate Openeye Name: methyl 2-[[6-methyl-4-(1-piperidyl)furo[2,3-d]pyrimidine-5-carbonyl]amino]-4-methylsulfanyl-butanoate CAS Name: 2-[[[6-methyl-4-(1-piperidinyl)-5-furo[2,3-d]pyrimidinyl]-oxomethyl]amino]-4-(methylthio)butanoic acid methyl ester IUPAC Name: methyl 2-[(6-methyl-4-piperidin-1-ylfuro[2,3-d]pyrimidine-5-carbonyl)amino]-4-methylsulfanylbutanoate Traditional Name: 2-[(6-methyl-4-piperidino-furo[2,3-d]pyrimidine-5-carbonyl)amino]-4-(methylthio)butyric acid methyl ester Formula: C19H26N4O4S MolecularWeight: 406.49914

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N=CN=C2O1)N3CCCCC3)C(=O)NC(CCSC)C(=O)OC

Isomeric SMILES

CC1=C(C2=C(N=CN=C2O1)N3CCCCC3)C(=O)NC(CCSC)C(=O)OC

InChI

InChI=1S/C19H26N4O4S/c1-12-14(17(24)22-13(7-10-28-3)19(25)26-2)15-16(20-11-21-18(15)27-12)23-8-5-4-6-9-23/h11,13H,4-10H2,1-3H3,(H,22,24)