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

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

CC(C)CNC1=NC2=C(C(=O)N1C3=CC=CC=C3)SC(=S)N2C4=CC=CC=C4

Isomeric SMILES

CC(C)CNC1=NC2=C(C(=O)N1C3=CC=CC=C3)SC(=S)N2C4=CC=CC=C4

InChI

InChI=1S/C21H20N4OS2/c1-14(2)13-22-20-23-18-17(19(26)25(20)16-11-7-4-8-12-16)28-21(27)24(18)15-9-5-3-6-10-15/h3-12,14H,13H2,1-2H3,(H,22,23)