2-[1-(2-methyl-1H-indol-3-yl)-1-oxidanylidene-propan-2-yl]sulfanyl-3-(oxolan-2-ylmethyl)quinazolin-4-one

Systemtic Name: 2-[1-(2-methyl-1H-indol-3-yl)-1-oxidanylidene-propan-2-yl]sulfanyl-3-(oxolan-2-ylmethyl)quinazolin-4-one Openeye Name: 2-[1-methyl-2-(2-methyl-1H-indol-3-yl)-2-oxo-ethyl]sulfanyl-3-(tetrahydrofuran-2-ylmethyl)quinazolin-4-one CAS Name: 2-[[1-(2-methyl-1H-indol-3-yl)-1-oxopropan-2-yl]thio]-3-(2-oxolanylmethyl)-4-quinazolinone IUPAC Name: 2-[1-(2-methyl-1H-indol-3-yl)-1-oxopropan-2-yl]sulfanyl-3-(oxolan-2-ylmethyl)quinazolin-4-one Traditional Name: 2-[[2-keto-1-methyl-2-(2-methyl-1H-indol-3-yl)ethyl]thio]-3-(tetrahydrofurfuryl)quinazolin-4-one Formula: C25H25N3O3S MolecularWeight: 447.5493

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2N1)C(=O)C(C)SC3=NC4=CC=CC=C4C(=O)N3CC5CCCO5

Isomeric SMILES

CC1=C(C2=CC=CC=C2N1)C(=O)C(C)SC3=NC4=CC=CC=C4C(=O)N3CC5CCCO5

InChI

InChI=1S/C25H25N3O3S/c1-15-22(18-9-3-5-11-20(18)26-15)23(29)16(2)32-25-27-21-12-6-4-10-19(21)24(30)28(25)14-17-8-7-13-31-17/h3-6,9-12,16-17,26H,7-8,13-14H2,1-2H3