methyl 2-[2-[2-[(3-aminocarbonylthiophen-2-yl)amino]-2-oxidanylidene-ethyl]sulfanyl-4-oxidanylidene-quinazolin-3-yl]ethanoate

Systemtic Name: methyl 2-[2-[2-[(3-aminocarbonylthiophen-2-yl)amino]-2-oxidanylidene-ethyl]sulfanyl-4-oxidanylidene-quinazolin-3-yl]ethanoate Openeye Name: methyl 2-[2-[2-[(3-carbamoyl-2-thienyl)amino]-2-oxo-ethyl]sulfanyl-4-oxo-quinazolin-3-yl]acetate CAS Name: 2-[2-[[2-[(3-carbamoyl-2-thiophenyl)amino]-2-oxoethyl]thio]-4-oxo-3-quinazolinyl]acetic acid methyl ester IUPAC Name: methyl 2-[2-[2-[(3-carbamoylthiophen-2-yl)amino]-2-oxoethyl]sulfanyl-4-oxoquinazolin-3-yl]acetate Traditional Name: 2-[2-[[2-[(3-carbamoyl-2-thienyl)amino]-2-keto-ethyl]thio]-4-keto-quinazolin-3-yl]acetic acid methyl ester Formula: C18H16N4O5S2 MolecularWeight: 432.47344

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC3=C(C=CS3)C(=O)N

Isomeric SMILES

COC(=O)CN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC3=C(C=CS3)C(=O)N

InChI

InChI=1S/C18H16N4O5S2/c1-27-14(24)8-22-17(26)10-4-2-3-5-12(10)20-18(22)29-9-13(23)21-16-11(15(19)25)6-7-28-16/h2-7H,8-9H2,1H3,(H2,19,25)(H,21,23)