7-chloranyl-3-(3-methylbutyl)-2-[(7-methyl-2-oxidanylidene-6-propan-2-yl-chromen-4-yl)methylsulfanyl]quinazolin-4-one

Systemtic Name: 7-chloranyl-3-(3-methylbutyl)-2-[(7-methyl-2-oxidanylidene-6-propan-2-yl-chromen-4-yl)methylsulfanyl]quinazolin-4-one Openeye Name: 7-chloro-3-isopentyl-2-[(6-isopropyl-7-methyl-2-oxo-chromen-4-yl)methylsulfanyl]quinazolin-4-one CAS Name: 7-chloro-3-(3-methylbutyl)-2-[(7-methyl-2-oxo-6-propan-2-yl-1-benzopyran-4-yl)methylthio]-4-quinazolinone IUPAC Name: 7-chloro-3-(3-methylbutyl)-2-[(7-methyl-2-oxo-6-propan-2-ylchromen-4-yl)methylsulfanyl]quinazolin-4-one Traditional Name: 7-chloro-3-isoamyl-2-[(6-isopropyl-2-keto-7-methyl-chromen-4-yl)methylthio]quinazolin-4-one Formula: C27H29ClN2O3S MolecularWeight: 497.04876

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=CC(=O)OC2=C1)CSC3=NC4=C(C=CC(=C4)Cl)C(=O)N3CCC(C)C)C(C)C

Isomeric SMILES

CC1=C(C=C2C(=CC(=O)OC2=C1)CSC3=NC4=C(C=CC(=C4)Cl)C(=O)N3CCC(C)C)C(C)C

InChI

InChI=1S/C27H29ClN2O3S/c1-15(2)8-9-30-26(32)20-7-6-19(28)12-23(20)29-27(30)34-14-18-11-25(31)33-24-10-17(5)21(16(3)4)13-22(18)24/h6-7,10-13,15-16H,8-9,14H2,1-5H3