7-chloranyl-2-[2-oxidanylidene-2-(4-phenylpiperazin-1-yl)ethyl]sulfanyl-3-(oxolan-2-ylmethyl)quinazolin-4-one

Systemtic Name: 7-chloranyl-2-[2-oxidanylidene-2-(4-phenylpiperazin-1-yl)ethyl]sulfanyl-3-(oxolan-2-ylmethyl)quinazolin-4-one Openeye Name: 7-chloro-2-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]sulfanyl-3-(tetrahydrofuran-2-ylmethyl)quinazolin-4-one CAS Name: 7-chloro-3-(2-oxolanylmethyl)-2-[[2-oxo-2-(4-phenyl-1-piperazinyl)ethyl]thio]-4-quinazolinone IUPAC Name: 7-chloro-3-(oxolan-2-ylmethyl)-2-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]sulfanylquinazolin-4-one Traditional Name: 7-chloro-2-[[2-keto-2-(4-phenylpiperazino)ethyl]thio]-3-(tetrahydrofurfuryl)quinazolin-4-one Formula: C25H27ClN4O3S MolecularWeight: 499.02488

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CN2C(=O)C3=C(C=C(C=C3)Cl)N=C2SCC(=O)N4CCN(CC4)C5=CC=CC=C5

Isomeric SMILES

C1CC(OC1)CN2C(=O)C3=C(C=C(C=C3)Cl)N=C2SCC(=O)N4CCN(CC4)C5=CC=CC=C5

InChI

InChI=1S/C25H27ClN4O3S/c26-18-8-9-21-22(15-18)27-25(30(24(21)32)16-20-7-4-14-33-20)34-17-23(31)29-12-10-28(11-13-29)19-5-2-1-3-6-19/h1-3,5-6,8-9,15,20H,4,7,10-14,16-17H2