6-chloranyl-2-[2-(2-methyl-2,3-dihydroindol-1-yl)-2-oxidanylidene-ethyl]sulfanyl-3-prop-2-enyl-quinazolin-4-one

Systemtic Name: 6-chloranyl-2-[2-(2-methyl-2,3-dihydroindol-1-yl)-2-oxidanylidene-ethyl]sulfanyl-3-prop-2-enyl-quinazolin-4-one Openeye Name: 3-allyl-6-chloro-2-[2-(2-methylindolin-1-yl)-2-oxo-ethyl]sulfanyl-quinazolin-4-one CAS Name: 6-chloro-2-[[2-(2-methyl-2,3-dihydroindol-1-yl)-2-oxoethyl]thio]-3-prop-2-enyl-4-quinazolinone IUPAC Name: 6-chloro-2-[2-(2-methyl-2,3-dihydroindol-1-yl)-2-oxoethyl]sulfanyl-3-prop-2-enylquinazolin-4-one Traditional Name: 3-allyl-6-chloro-2-[[2-keto-2-(2-methylindolin-1-yl)ethyl]thio]quinazolin-4-one Formula: C22H20ClN3O2S MolecularWeight: 425.9311

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=CC=CC=C2N1C(=O)CSC3=NC4=C(C=C(C=C4)Cl)C(=O)N3CC=C

Isomeric SMILES

CC1CC2=CC=CC=C2N1C(=O)CSC3=NC4=C(C=C(C=C4)Cl)C(=O)N3CC=C

InChI

InChI=1S/C22H20ClN3O2S/c1-3-10-25-21(28)17-12-16(23)8-9-18(17)24-22(25)29-13-20(27)26-14(2)11-15-6-4-5-7-19(15)26/h3-9,12,14H,1,10-11,13H2,2H3