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

Systemtic Name: N-[3-[2-azanyl-4-oxidanylidene-6-(phenylmethyl)-1H-pyrimidin-5-yl]propyl]-4-methyl-N-phenyl-benzenesulfonamide Openeye Name: N-[3-(2-amino-6-benzyl-4-oxo-1H-pyrimidin-5-yl)propyl]-4-methyl-N-phenyl-benzenesulfonamide CAS Name: N-[3-[2-amino-4-oxo-6-(phenylmethyl)-1H-pyrimidin-5-yl]propyl]-4-methyl-N-phenylbenzenesulfonamide IUPAC Name: N-[3-(2-amino-6-benzyl-4-oxo-1H-pyrimidin-5-yl)propyl]-4-methyl-N-phenylbenzenesulfonamide Traditional Name: N-[3-(2-amino-6-benzyl-4-keto-1H-pyrimidin-5-yl)propyl]-4-methyl-N-phenyl-benzenesulfonamide Formula: C27H28N4O3S MolecularWeight: 488.60122

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CCCC2=C(NC(=NC2=O)N)CC3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CCCC2=C(NC(=NC2=O)N)CC3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C27H28N4O3S/c1-20-14-16-23(17-15-20)35(33,34)31(22-11-6-3-7-12-22)18-8-13-24-25(29-27(28)30-26(24)32)19-21-9-4-2-5-10-21/h2-7,9-12,14-17H,8,13,18-19H2,1H3,(H3,28,29,30,32)