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

Systemtic Name: methyl 3-[2-[2-[cyclohexen-1-yl(cyclopropyl)amino]-2-oxidanylidene-ethyl]sulfanyl-4-oxidanylidene-quinazolin-3-yl]propanoate Openeye Name: methyl 3-[2-[2-[cyclohexen-1-yl(cyclopropyl)amino]-2-oxo-ethyl]sulfanyl-4-oxo-quinazolin-3-yl]propanoate CAS Name: 3-[2-[[2-[1-cyclohexenyl(cyclopropyl)amino]-2-oxoethyl]thio]-4-oxo-3-quinazolinyl]propanoic acid methyl ester IUPAC Name: methyl 3-[2-[2-[cyclohexen-1-yl(cyclopropyl)amino]-2-oxoethyl]sulfanyl-4-oxoquinazolin-3-yl]propanoate Traditional Name: 3-[2-[[2-[cyclohexen-1-yl(cyclopropyl)amino]-2-keto-ethyl]thio]-4-keto-quinazolin-3-yl]propionic acid methyl ester Formula: C23H27N3O4S MolecularWeight: 441.54318

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)N(C3CC3)C4=CCCCC4

Isomeric SMILES

COC(=O)CCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)N(C3CC3)C4=CCCCC4

InChI

InChI=1S/C23H27N3O4S/c1-30-21(28)13-14-25-22(29)18-9-5-6-10-19(18)24-23(25)31-15-20(27)26(17-11-12-17)16-7-3-2-4-8-16/h5-7,9-10,17H,2-4,8,11-15H2,1H3