3-butyl-2-[2-oxidanylidene-3-(1,3,3-trimethylindol-2-ylidene)propyl]sulfanyl-quinazolin-4-one

Systemtic Name: 3-butyl-2-[2-oxidanylidene-3-(1,3,3-trimethylindol-2-ylidene)propyl]sulfanyl-quinazolin-4-one Openeye Name: 3-butyl-2-[2-oxo-3-(1,3,3-trimethylindolin-2-ylidene)propyl]sulfanyl-quinazolin-4-one CAS Name: 3-butyl-2-[[2-oxo-3-(1,3,3-trimethyl-2-indolylidene)propyl]thio]-4-quinazolinone IUPAC Name: 3-butyl-2-[2-oxo-3-(1,3,3-trimethylindol-2-ylidene)propyl]sulfanylquinazolin-4-one Traditional Name: 3-butyl-2-[[2-keto-3-(1,3,3-trimethylindolin-2-ylidene)propyl]thio]quinazolin-4-one Formula: C26H29N3O2S MolecularWeight: 447.59236

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)C=C3C(C4=CC=CC=C4N3C)(C)C

Isomeric SMILES

CCCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)C=C3C(C4=CC=CC=C4N3C)(C)C

InChI

InChI=1S/C26H29N3O2S/c1-5-6-15-29-24(31)19-11-7-9-13-21(19)27-25(29)32-17-18(30)16-23-26(2,3)20-12-8-10-14-22(20)28(23)4/h7-14,16H,5-6,15,17H2,1-4H3