5-(butylamino)-3,6-diphenyl-2-sulfanylidene-[1,3]thiazolo[4,5-d]pyrimidin-7-one

Systemtic Name: 5-(butylamino)-3,6-diphenyl-2-sulfanylidene-[1,3]thiazolo[4,5-d]pyrimidin-7-one Openeye Name: 5-(butylamino)-3,6-diphenyl-2-thioxo-thiazolo[4,5-d]pyrimidin-7-one CAS Name: 5-(butylamino)-3,6-diphenyl-2-sulfanylidene-7-thiazolo[4,5-d]pyrimidinone IUPAC Name: 5-(butylamino)-3,6-diphenyl-2-sulfanylidene-[1,3]thiazolo[4,5-d]pyrimidin-7-one Traditional Name: 5-(butylamino)-3,6-diphenyl-2-thioxo-thiazolo[4,5-d]pyrimidin-7-one Formula: C21H20N4OS2 MolecularWeight: 408.5397

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=NC2=C(C(=O)N1C3=CC=CC=C3)SC(=S)N2C4=CC=CC=C4

Isomeric SMILES

CCCCNC1=NC2=C(C(=O)N1C3=CC=CC=C3)SC(=S)N2C4=CC=CC=C4

InChI

InChI=1S/C21H20N4OS2/c1-2-3-14-22-20-23-18-17(19(26)25(20)16-12-8-5-9-13-16)28-21(27)24(18)15-10-6-4-7-11-15/h4-13H,2-3,14H2,1H3,(H,22,23)