3-[4-[2-(3-chloranyl-2-methyl-phenyl)imino-1,3-thiazolidin-3-yl]-4-oxidanylidene-butyl]quinazolin-4-one

Systemtic Name: 3-[4-[2-(3-chloranyl-2-methyl-phenyl)imino-1,3-thiazolidin-3-yl]-4-oxidanylidene-butyl]quinazolin-4-one Openeye Name: 3-[4-[2-(3-chloro-2-methyl-phenyl)iminothiazolidin-3-yl]-4-oxo-butyl]quinazolin-4-one CAS Name: 3-[4-[2-(3-chloro-2-methylphenyl)imino-3-thiazolidinyl]-4-oxobutyl]-4-quinazolinone IUPAC Name: 3-[4-[2-(3-chloro-2-methylphenyl)imino-1,3-thiazolidin-3-yl]-4-oxobutyl]quinazolin-4-one Traditional Name: 3-[4-[2-(3-chloro-2-methyl-phenyl)iminothiazolidin-3-yl]-4-keto-butyl]quinazolin-4-one Formula: C22H21ClN4O2S MolecularWeight: 440.94574

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)N=C2N(CCS2)C(=O)CCCN3C=NC4=CC=CC=C4C3=O

Isomeric SMILES

CC1=C(C=CC=C1Cl)N=C2N(CCS2)C(=O)CCCN3C=NC4=CC=CC=C4C3=O

InChI

InChI=1S/C22H21ClN4O2S/c1-15-17(23)7-4-9-18(15)25-22-27(12-13-30-22)20(28)10-5-11-26-14-24-19-8-3-2-6-16(19)21(26)29/h2-4,6-9,14H,5,10-13H2,1H3