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

Systemtic Name: 7-chloranyl-2-[2-oxidanylidene-2-(4-phenylpiperazin-1-yl)ethyl]sulfanyl-3-pentyl-quinazolin-4-one Openeye Name: 7-chloro-2-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]sulfanyl-3-pentyl-quinazolin-4-one CAS Name: 7-chloro-2-[[2-oxo-2-(4-phenyl-1-piperazinyl)ethyl]thio]-3-pentyl-4-quinazolinone IUPAC Name: 7-chloro-2-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]sulfanyl-3-pentylquinazolin-4-one Traditional Name: 3-amyl-7-chloro-2-[[2-keto-2-(4-phenylpiperazino)ethyl]thio]quinazolin-4-one Formula: C25H29ClN4O2S MolecularWeight: 485.04136

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=O)C2=C(C=C(C=C2)Cl)N=C1SCC(=O)N3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

CCCCCN1C(=O)C2=C(C=C(C=C2)Cl)N=C1SCC(=O)N3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C25H29ClN4O2S/c1-2-3-7-12-30-24(32)21-11-10-19(26)17-22(21)27-25(30)33-18-23(31)29-15-13-28(14-16-29)20-8-5-4-6-9-20/h4-6,8-11,17H,2-3,7,12-16,18H2,1H3