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

Systemtic Name: 2-[2-(2-methyl-1H-indol-3-yl)-2-oxidanylidene-ethyl]sulfanyl-3-(4-phenoxyphenyl)quinazolin-4-one Openeye Name: 2-[2-(2-methyl-1H-indol-3-yl)-2-oxo-ethyl]sulfanyl-3-(4-phenoxyphenyl)quinazolin-4-one CAS Name: 2-[[2-(2-methyl-1H-indol-3-yl)-2-oxoethyl]thio]-3-(4-phenoxyphenyl)-4-quinazolinone IUPAC Name: 2-[2-(2-methyl-1H-indol-3-yl)-2-oxoethyl]sulfanyl-3-(4-phenoxyphenyl)quinazolin-4-one Traditional Name: 2-[[2-keto-2-(2-methyl-1H-indol-3-yl)ethyl]thio]-3-(4-phenoxyphenyl)quinazolin-4-one Formula: C31H23N3O3S MolecularWeight: 517.59762

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2N1)C(=O)CSC3=NC4=CC=CC=C4C(=O)N3C5=CC=C(C=C5)OC6=CC=CC=C6

Isomeric SMILES

CC1=C(C2=CC=CC=C2N1)C(=O)CSC3=NC4=CC=CC=C4C(=O)N3C5=CC=C(C=C5)OC6=CC=CC=C6

InChI

InChI=1S/C31H23N3O3S/c1-20-29(24-11-5-7-13-26(24)32-20)28(35)19-38-31-33-27-14-8-6-12-25(27)30(36)34(31)21-15-17-23(18-16-21)37-22-9-3-2-4-10-22/h2-18,32H,19H2,1H3