7-chloranyl-2-[2-(4-ethylphenyl)-2-oxidanylidene-ethyl]sulfanyl-3-(3-methylbutyl)quinazolin-4-one

Systemtic Name: 7-chloranyl-2-[2-(4-ethylphenyl)-2-oxidanylidene-ethyl]sulfanyl-3-(3-methylbutyl)quinazolin-4-one Openeye Name: 7-chloro-2-[2-(4-ethylphenyl)-2-oxo-ethyl]sulfanyl-3-isopentyl-quinazolin-4-one CAS Name: 7-chloro-2-[[2-(4-ethylphenyl)-2-oxoethyl]thio]-3-(3-methylbutyl)-4-quinazolinone IUPAC Name: 7-chloro-2-[2-(4-ethylphenyl)-2-oxoethyl]sulfanyl-3-(3-methylbutyl)quinazolin-4-one Traditional Name: 7-chloro-2-[[2-(4-ethylphenyl)-2-keto-ethyl]thio]-3-isoamyl-quinazolin-4-one Formula: C23H25ClN2O2S MolecularWeight: 428.9748

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)CSC2=NC3=C(C=CC(=C3)Cl)C(=O)N2CCC(C)C

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)CSC2=NC3=C(C=CC(=C3)Cl)C(=O)N2CCC(C)C

InChI

InChI=1S/C23H25ClN2O2S/c1-4-16-5-7-17(8-6-16)21(27)14-29-23-25-20-13-18(24)9-10-19(20)22(28)26(23)12-11-15(2)3/h5-10,13,15H,4,11-12,14H2,1-3H3