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

Systemtic Name: 3-methyl-2-[(2S)-1-(2-methyl-1H-indol-3-yl)-1-oxidanylidene-propan-2-yl]sulfanyl-quinazolin-4-one Openeye Name: 3-methyl-2-[(1S)-1-methyl-2-(2-methyl-1H-indol-3-yl)-2-oxo-ethyl]sulfanyl-quinazolin-4-one CAS Name: 3-methyl-2-[[(2S)-1-(2-methyl-1H-indol-3-yl)-1-oxopropan-2-yl]thio]-4-quinazolinone IUPAC Name: 3-methyl-2-[(2S)-1-(2-methyl-1H-indol-3-yl)-1-oxopropan-2-yl]sulfanylquinazolin-4-one Traditional Name: 2-[[(1S)-2-keto-1-methyl-2-(2-methyl-1H-indol-3-yl)ethyl]thio]-3-methyl-quinazolin-4-one Formula: C21H19N3O2S MolecularWeight: 377.45946

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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)N3C

Isomeric SMILES

CC1=C(C2=CC=CC=C2N1)C(=O)[C@H](C)SC3=NC4=CC=CC=C4C(=O)N3C

InChI

InChI=1S/C21H19N3O2S/c1-12-18(14-8-4-6-10-16(14)22-12)19(25)13(2)27-21-23-17-11-7-5-9-15(17)20(26)24(21)3/h4-11,13,22H,1-3H3/t13-/m0/s1