ethyl 4-[2-[2-(3-methoxypropylamino)-2-oxidanylidene-ethyl]sulfanyl-4-oxidanylidene-quinazolin-3-yl]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[2-[2-(3-methoxypropylamino)-2-oxidanylidene-ethyl]sulfanyl-4-oxidanylidene-quinazolin-3-yl]piperidine-1-carboxylate Openeye Name: ethyl 4-[2-[2-(3-methoxypropylamino)-2-oxo-ethyl]sulfanyl-4-oxo-quinazolin-3-yl]piperidine-1-carboxylate CAS Name: 4-[2-[[2-(3-methoxypropylamino)-2-oxoethyl]thio]-4-oxo-3-quinazolinyl]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-[2-(3-methoxypropylamino)-2-oxoethyl]sulfanyl-4-oxoquinazolin-3-yl]piperidine-1-carboxylate Traditional Name: 4-[4-keto-2-[[2-keto-2-(3-methoxypropylamino)ethyl]thio]quinazolin-3-yl]piperidine-1-carboxylic acid ethyl ester Formula: C22H30N4O5S MolecularWeight: 462.5624

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NCCCOC

Isomeric SMILES

CCOC(=O)N1CCC(CC1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NCCCOC

InChI

InChI=1S/C22H30N4O5S/c1-3-31-22(29)25-12-9-16(10-13-25)26-20(28)17-7-4-5-8-18(17)24-21(26)32-15-19(27)23-11-6-14-30-2/h4-5,7-8,16H,3,6,9-15H2,1-2H3,(H,23,27)