N-[3-(2-azanyl-6-methyl-4-oxidanylidene-1H-pyrimidin-5-yl)propyl]-4-ethanoyl-benzenesulfonamide

Systemtic Name: N-[3-(2-azanyl-6-methyl-4-oxidanylidene-1H-pyrimidin-5-yl)propyl]-4-ethanoyl-benzenesulfonamide Openeye Name: 4-acetyl-N-[3-(2-amino-6-methyl-4-oxo-1H-pyrimidin-5-yl)propyl]benzenesulfonamide CAS Name: 4-acetyl-N-[3-(2-amino-6-methyl-4-oxo-1H-pyrimidin-5-yl)propyl]benzenesulfonamide IUPAC Name: 4-acetyl-N-[3-(2-amino-6-methyl-4-oxo-1H-pyrimidin-5-yl)propyl]benzenesulfonamide Traditional Name: 4-acetyl-N-[3-(2-amino-4-keto-6-methyl-1H-pyrimidin-5-yl)propyl]benzenesulfonamide Formula: C16H20N4O4S MolecularWeight: 364.4194

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=C(N1)N)CCCNS(=O)(=O)C2=CC=C(C=C2)C(=O)C

Isomeric SMILES

CC1=C(C(=O)N=C(N1)N)CCCNS(=O)(=O)C2=CC=C(C=C2)C(=O)C

InChI

InChI=1S/C16H20N4O4S/c1-10-14(15(22)20-16(17)19-10)4-3-9-18-25(23,24)13-7-5-12(6-8-13)11(2)21/h5-8,18H,3-4,9H2,1-2H3,(H3,17,19,20,22)