methyl 2-[2-[2-[[(2R)-butan-2-yl]carbamoylamino]-2-oxidanylidene-ethyl]sulfanyl-4-oxidanylidene-quinazolin-3-yl]ethanoate

Systemtic Name: methyl 2-[2-[2-[[(2R)-butan-2-yl]carbamoylamino]-2-oxidanylidene-ethyl]sulfanyl-4-oxidanylidene-quinazolin-3-yl]ethanoate Openeye Name: methyl 2-[2-[2-[[(1R)-1-methylpropyl]carbamoylamino]-2-oxo-ethyl]sulfanyl-4-oxo-quinazolin-3-yl]acetate CAS Name: 2-[2-[[2-[[[[(2R)-butan-2-yl]amino]-oxomethyl]amino]-2-oxoethyl]thio]-4-oxo-3-quinazolinyl]acetic acid methyl ester IUPAC Name: methyl 2-[2-[2-[[(2R)-butan-2-yl]carbamoylamino]-2-oxoethyl]sulfanyl-4-oxoquinazolin-3-yl]acetate Traditional Name: 2-[4-keto-2-[[2-keto-2-[[(1R)-1-methylpropyl]carbamoylamino]ethyl]thio]quinazolin-3-yl]acetic acid methyl ester Formula: C18H22N4O5S MolecularWeight: 406.45608

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)NC(=O)CSC1=NC2=CC=CC=C2C(=O)N1CC(=O)OC

Isomeric SMILES

CC[C@@H](C)NC(=O)NC(=O)CSC1=NC2=CC=CC=C2C(=O)N1CC(=O)OC

InChI

InChI=1S/C18H22N4O5S/c1-4-11(2)19-17(26)21-14(23)10-28-18-20-13-8-6-5-7-12(13)16(25)22(18)9-15(24)27-3/h5-8,11H,4,9-10H2,1-3H3,(H2,19,21,23,26)/t11-/m1/s1