3-[(2S)-1-methoxypropan-2-yl]-2-[2-oxidanylidene-2-(5-pyrrolidin-1-ylcarbonyl-1H-pyrrol-3-yl)ethyl]sulfanyl-quinazolin-4-one

Systemtic Name: 3-[(2S)-1-methoxypropan-2-yl]-2-[2-oxidanylidene-2-(5-pyrrolidin-1-ylcarbonyl-1H-pyrrol-3-yl)ethyl]sulfanyl-quinazolin-4-one Openeye Name: 3-[(1S)-2-methoxy-1-methyl-ethyl]-2-[2-oxo-2-[5-(pyrrolidine-1-carbonyl)-1H-pyrrol-3-yl]ethyl]sulfanyl-quinazolin-4-one CAS Name: 3-[(2S)-1-methoxypropan-2-yl]-2-[[2-oxo-2-[5-[oxo(1-pyrrolidinyl)methyl]-1H-pyrrol-3-yl]ethyl]thio]-4-quinazolinone IUPAC Name: 3-[(2S)-1-methoxypropan-2-yl]-2-[2-oxo-2-[5-(pyrrolidine-1-carbonyl)-1H-pyrrol-3-yl]ethyl]sulfanylquinazolin-4-one Traditional Name: 2-[[2-keto-2-[5-(pyrrolidine-1-carbonyl)-1H-pyrrol-3-yl]ethyl]thio]-3-[(1S)-2-methoxy-1-methyl-ethyl]quinazolin-4-one Formula: C23H26N4O4S MolecularWeight: 454.54194

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Descriptors Computed from Structure

Canonical SMILES:

CC(COC)N1C(=O)C2=CC=CC=C2N=C1SCC(=O)C3=CNC(=C3)C(=O)N4CCCC4

Isomeric SMILES

C[C@@H](COC)N1C(=O)C2=CC=CC=C2N=C1SCC(=O)C3=CNC(=C3)C(=O)N4CCCC4

InChI

InChI=1S/C23H26N4O4S/c1-15(13-31-2)27-21(29)17-7-3-4-8-18(17)25-23(27)32-14-20(28)16-11-19(24-12-16)22(30)26-9-5-6-10-26/h3-4,7-8,11-12,15,24H,5-6,9-10,13-14H2,1-2H3/t15-/m0/s1