methyl 2-[2-[2-[cyclohexen-1-yl(cyclopropyl)amino]-2-oxidanylidene-ethyl]sulfanyl-4-oxidanylidene-quinazolin-3-yl]ethanoate

Systemtic Name: methyl 2-[2-[2-[cyclohexen-1-yl(cyclopropyl)amino]-2-oxidanylidene-ethyl]sulfanyl-4-oxidanylidene-quinazolin-3-yl]ethanoate Openeye Name: methyl 2-[2-[2-[cyclohexen-1-yl(cyclopropyl)amino]-2-oxo-ethyl]sulfanyl-4-oxo-quinazolin-3-yl]acetate CAS Name: 2-[2-[[2-[1-cyclohexenyl(cyclopropyl)amino]-2-oxoethyl]thio]-4-oxo-3-quinazolinyl]acetic acid methyl ester IUPAC Name: methyl 2-[2-[2-[cyclohexen-1-yl(cyclopropyl)amino]-2-oxoethyl]sulfanyl-4-oxoquinazolin-3-yl]acetate Traditional Name: 2-[2-[[2-[cyclohexen-1-yl(cyclopropyl)amino]-2-keto-ethyl]thio]-4-keto-quinazolin-3-yl]acetic acid methyl ester Formula: C22H25N3O4S MolecularWeight: 427.5166

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CN1C(=O)C2=CC=CC=C2N=C1SCC(=O)N(C3CC3)C4=CCCCC4

Isomeric SMILES

COC(=O)CN1C(=O)C2=CC=CC=C2N=C1SCC(=O)N(C3CC3)C4=CCCCC4

InChI

InChI=1S/C22H25N3O4S/c1-29-20(27)13-24-21(28)17-9-5-6-10-18(17)23-22(24)30-14-19(26)25(16-11-12-16)15-7-3-2-4-8-15/h5-7,9-10,16H,2-4,8,11-14H2,1H3