3-(azepan-1-ylcarbonyl)-7-methyl-1-sulfanylidene-4H-[1,3]thiazolo[3,4-a]quinazolin-5-one

Systemtic Name: 3-(azepan-1-ylcarbonyl)-7-methyl-1-sulfanylidene-4H-[1,3]thiazolo[3,4-a]quinazolin-5-one Openeye Name: 3-(azepane-1-carbonyl)-7-methyl-1-thioxo-4H-thiazolo[3,4-a]quinazolin-5-one CAS Name: 3-[1-azepanyl(oxo)methyl]-7-methyl-1-sulfanylidene-4H-thiazolo[3,4-a]quinazolin-5-one IUPAC Name: 3-(azepane-1-carbonyl)-7-methyl-1-sulfanylidene-4H-[1,3]thiazolo[3,4-a]quinazolin-5-one Traditional Name: 3-(azepane-1-carbonyl)-7-methyl-1-thioxo-4H-thiazolo[3,4-a]quinazolin-5-one Formula: C18H19N3O2S2 MolecularWeight: 373.49236

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N3C(=C(SC3=S)C(=O)N4CCCCCC4)NC2=O

Isomeric SMILES

CC1=CC2=C(C=C1)N3C(=C(SC3=S)C(=O)N4CCCCCC4)NC2=O

InChI

InChI=1S/C18H19N3O2S2/c1-11-6-7-13-12(10-11)16(22)19-15-14(25-18(24)21(13)15)17(23)20-8-4-2-3-5-9-20/h6-7,10H,2-5,8-9H2,1H3,(H,19,22)