2-[3-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)-3-oxidanylidene-propyl]sulfanyl-3-ethyl-quinazolin-4-one

Systemtic Name: 2-[3-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)-3-oxidanylidene-propyl]sulfanyl-3-ethyl-quinazolin-4-one Openeye Name: 2-[3-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)-3-oxo-propyl]sulfanyl-3-ethyl-quinazolin-4-one CAS Name: 2-[[3-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)-3-oxopropyl]thio]-3-ethyl-4-quinazolinone IUPAC Name: 2-[3-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)-3-oxopropyl]sulfanyl-3-ethylquinazolin-4-one Traditional Name: 2-[[3-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)-3-keto-propyl]thio]-3-ethyl-quinazolin-4-one Formula: C27H25N3O2S MolecularWeight: 455.5713

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=CC=CC=C2N=C1SCCC(=O)N3C4=CC=CC=C4CCC5=CC=CC=C53

Isomeric SMILES

CCN1C(=O)C2=CC=CC=C2N=C1SCCC(=O)N3C4=CC=CC=C4CCC5=CC=CC=C53

InChI

InChI=1S/C27H25N3O2S/c1-2-29-26(32)21-11-5-6-12-22(21)28-27(29)33-18-17-25(31)30-23-13-7-3-9-19(23)15-16-20-10-4-8-14-24(20)30/h3-14H,2,15-18H2,1H3