2-diethylaminoethyl 4-[2-[(4-oxidanylidene-1H-quinazolin-2-yl)sulfanyl]ethanoylamino]benzoate

Systemtic Name: 2-diethylaminoethyl 4-[2-[(4-oxidanylidene-1H-quinazolin-2-yl)sulfanyl]ethanoylamino]benzoate Openeye Name: 2-diethylaminoethyl 4-[[2-[(4-oxo-1H-quinazolin-2-yl)sulfanyl]acetyl]amino]benzoate CAS Name: 4-[[1-oxo-2-[(4-oxo-1H-quinazolin-2-yl)thio]ethyl]amino]benzoic acid 2-diethylaminoethyl ester IUPAC Name: 2-diethylaminoethyl 4-[[2-[(4-oxo-1H-quinazolin-2-yl)sulfanyl]acetyl]amino]benzoate Traditional Name: 4-[[2-[(4-keto-1H-quinazolin-2-yl)thio]acetyl]amino]benzoic acid 2-diethylaminoethyl ester Formula: C23H26N4O4S MolecularWeight: 454.54194

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCOC(=O)C1=CC=C(C=C1)NC(=O)CSC2=NC(=O)C3=CC=CC=C3N2

Isomeric SMILES

CCN(CC)CCOC(=O)C1=CC=C(C=C1)NC(=O)CSC2=NC(=O)C3=CC=CC=C3N2

InChI

InChI=1S/C23H26N4O4S/c1-3-27(4-2)13-14-31-22(30)16-9-11-17(12-10-16)24-20(28)15-32-23-25-19-8-6-5-7-18(19)21(29)26-23/h5-12H,3-4,13-15H2,1-2H3,(H,24,28)(H,25,26,29)