methyl 2-[4-oxidanylidene-2-[1-oxidanylidene-1-[(phenylmethyl)carbamoylamino]propan-2-yl]sulfanyl-quinazolin-3-yl]ethanoate

Systemtic Name: methyl 2-[4-oxidanylidene-2-[1-oxidanylidene-1-[(phenylmethyl)carbamoylamino]propan-2-yl]sulfanyl-quinazolin-3-yl]ethanoate Openeye Name: methyl 2-[2-[2-(benzylcarbamoylamino)-1-methyl-2-oxo-ethyl]sulfanyl-4-oxo-quinazolin-3-yl]acetate CAS Name: 2-[4-oxo-2-[[1-oxo-1-[[oxo-[(phenylmethyl)amino]methyl]amino]propan-2-yl]thio]-3-quinazolinyl]acetic acid methyl ester IUPAC Name: methyl 2-[2-[1-(benzylcarbamoylamino)-1-oxopropan-2-yl]sulfanyl-4-oxoquinazolin-3-yl]acetate Traditional Name: 2-[2-[[2-(benzylcarbamoylamino)-2-keto-1-methyl-ethyl]thio]-4-keto-quinazolin-3-yl]acetic acid methyl ester Formula: C22H22N4O5S MolecularWeight: 454.49888

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(=O)NCC1=CC=CC=C1)SC2=NC3=CC=CC=C3C(=O)N2CC(=O)OC

Isomeric SMILES

CC(C(=O)NC(=O)NCC1=CC=CC=C1)SC2=NC3=CC=CC=C3C(=O)N2CC(=O)OC

InChI

InChI=1S/C22H22N4O5S/c1-14(19(28)25-21(30)23-12-15-8-4-3-5-9-15)32-22-24-17-11-7-6-10-16(17)20(29)26(22)13-18(27)31-2/h3-11,14H,12-13H2,1-2H3,(H2,23,25,28,30)