2-methyl-7-morpholin-4-ylsulfonyl-9-nitro-[1,3,4]thiadiazolo[3,2-a]quinazolin-5-one

Systemtic Name: 2-methyl-7-morpholin-4-ylsulfonyl-9-nitro-[1,3,4]thiadiazolo[3,2-a]quinazolin-5-one Openeye Name: 2-methyl-7-morpholinosulfonyl-9-nitro-[1,3,4]thiadiazolo[3,2-a]quinazolin-5-one CAS Name: 2-methyl-7-(4-morpholinylsulfonyl)-9-nitro-[1,3,4]thiadiazolo[3,2-a]quinazolin-5-one IUPAC Name: 2-methyl-7-morpholin-4-ylsulfonyl-9-nitro-[1,3,4]thiadiazolo[3,2-a]quinazolin-5-one Traditional Name: 2-methyl-7-morpholinosulfonyl-9-nitro-[1,3,4]thiadiazolo[3,2-a]quinazolin-5-one Formula: C14H13N5O6S2 MolecularWeight: 411.41292

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN2C3=C(C=C(C=C3C(=O)N=C2S1)S(=O)(=O)N4CCOCC4)[N+](=O)[O-]

Isomeric SMILES

CC1=NN2C3=C(C=C(C=C3C(=O)N=C2S1)S(=O)(=O)N4CCOCC4)[N+](=O)[O-]

InChI

InChI=1S/C14H13N5O6S2/c1-8-16-18-12-10(13(20)15-14(18)26-8)6-9(7-11(12)19(21)22)27(23,24)17-2-4-25-5-3-17/h6-7H,2-5H2,1H3