6-butyl-3-(2-methoxyphenyl)-5-phenacylsulfanyl-2-sulfanylidene-[1,3]thiazolo[4,5-d]pyrimidin-7-one

Systemtic Name: 6-butyl-3-(2-methoxyphenyl)-5-phenacylsulfanyl-2-sulfanylidene-[1,3]thiazolo[4,5-d]pyrimidin-7-one Openeye Name: 6-butyl-3-(2-methoxyphenyl)-5-phenacylsulfanyl-2-thioxo-thiazolo[4,5-d]pyrimidin-7-one CAS Name: 6-butyl-3-(2-methoxyphenyl)-5-(phenacylthio)-2-sulfanylidene-7-thiazolo[4,5-d]pyrimidinone IUPAC Name: 6-butyl-3-(2-methoxyphenyl)-5-phenacylsulfanyl-2-sulfanylidene-[1,3]thiazolo[4,5-d]pyrimidin-7-one Traditional Name: 6-butyl-3-(2-methoxyphenyl)-5-(phenacylthio)-2-thioxo-thiazolo[4,5-d]pyrimidin-7-one Formula: C24H23N3O3S3 MolecularWeight: 497.65272

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=C(N=C1SCC(=O)C3=CC=CC=C3)N(C(=S)S2)C4=CC=CC=C4OC

Isomeric SMILES

CCCCN1C(=O)C2=C(N=C1SCC(=O)C3=CC=CC=C3)N(C(=S)S2)C4=CC=CC=C4OC

InChI

InChI=1S/C24H23N3O3S3/c1-3-4-14-26-22(29)20-21(25-23(26)32-15-18(28)16-10-6-5-7-11-16)27(24(31)33-20)17-12-8-9-13-19(17)30-2/h5-13H,3-4,14-15H2,1-2H3