methyl (2R)-2-[[(2R)-2-[(6-azanyl-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]butanoyl]amino]-4-methyl-pentanoate

Systemtic Name: methyl (2R)-2-[[(2R)-2-[(6-azanyl-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]butanoyl]amino]-4-methyl-pentanoate Openeye Name: methyl (2R)-2-[[(2R)-2-[(6-amino-4-oxo-1H-pyrimidin-2-yl)sulfanyl]butanoyl]amino]-4-methyl-pentanoate CAS Name: (2R)-2-[[(2R)-2-[(6-amino-4-oxo-1H-pyrimidin-2-yl)thio]-1-oxobutyl]amino]-4-methylpentanoic acid methyl ester IUPAC Name: methyl (2R)-2-[[(2R)-2-[(6-amino-4-oxo-1H-pyrimidin-2-yl)sulfanyl]butanoyl]amino]-4-methylpentanoate Traditional Name: (2R)-2-[[(2R)-2-[(6-amino-4-keto-1H-pyrimidin-2-yl)thio]butanoyl]amino]-4-methyl-valeric acid methyl ester Formula: C15H24N4O4S MolecularWeight: 356.44046

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC(CC(C)C)C(=O)OC)SC1=NC(=O)C=C(N1)N

Isomeric SMILES

CC[C@H](C(=O)N[C@H](CC(C)C)C(=O)OC)SC1=NC(=O)C=C(N1)N

InChI

InChI=1S/C15H24N4O4S/c1-5-10(24-15-18-11(16)7-12(20)19-15)13(21)17-9(6-8(2)3)14(22)23-4/h7-10H,5-6H2,1-4H3,(H,17,21)(H3,16,18,19,20)/t9-,10-/m1/s1