3-cyclohexyl-2-[2-(2-methyl-1H-indol-3-yl)-2-oxidanylidene-ethyl]sulfanyl-quinazolin-4-one

Systemtic Name: 3-cyclohexyl-2-[2-(2-methyl-1H-indol-3-yl)-2-oxidanylidene-ethyl]sulfanyl-quinazolin-4-one Openeye Name: 3-cyclohexyl-2-[2-(2-methyl-1H-indol-3-yl)-2-oxo-ethyl]sulfanyl-quinazolin-4-one CAS Name: 3-cyclohexyl-2-[[2-(2-methyl-1H-indol-3-yl)-2-oxoethyl]thio]-4-quinazolinone IUPAC Name: 3-cyclohexyl-2-[2-(2-methyl-1H-indol-3-yl)-2-oxoethyl]sulfanylquinazolin-4-one Traditional Name: 3-cyclohexyl-2-[[2-keto-2-(2-methyl-1H-indol-3-yl)ethyl]thio]quinazolin-4-one Formula: C25H25N3O2S MolecularWeight: 431.5499

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2N1)C(=O)CSC3=NC4=CC=CC=C4C(=O)N3C5CCCCC5

Isomeric SMILES

CC1=C(C2=CC=CC=C2N1)C(=O)CSC3=NC4=CC=CC=C4C(=O)N3C5CCCCC5

InChI

InChI=1S/C25H25N3O2S/c1-16-23(18-11-5-7-13-20(18)26-16)22(29)15-31-25-27-21-14-8-6-12-19(21)24(30)28(25)17-9-3-2-4-10-17/h5-8,11-14,17,26H,2-4,9-10,15H2,1H3