2-azanyl-4-oxidanylidene-5-(4-phenylbutyl)-N'-(phenylsulfonyl)-1H-pyrimidine-6-carbohydrazide

Systemtic Name: 2-azanyl-4-oxidanylidene-5-(4-phenylbutyl)-N'-(phenylsulfonyl)-1H-pyrimidine-6-carbohydrazide Openeye Name: 2-amino-N'-(benzenesulfonyl)-4-oxo-5-(4-phenylbutyl)-1H-pyrimidine-6-carbohydrazide CAS Name: 2-amino-N'-(benzenesulfonyl)-4-oxo-5-(4-phenylbutyl)-1H-pyrimidine-6-carbohydrazide IUPAC Name: 2-amino-N'-(benzenesulfonyl)-4-oxo-5-(4-phenylbutyl)-1H-pyrimidine-6-carbohydrazide Traditional Name: 2-amino-N'-besyl-4-keto-5-(4-phenylbutyl)-1H-pyrimidine-6-carbohydrazide Formula: C21H23N5O4S MolecularWeight: 441.50342

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCCC2=C(NC(=NC2=O)N)C(=O)NNS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)CCCCC2=C(NC(=NC2=O)N)C(=O)NNS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H23N5O4S/c22-21-23-18(20(28)25-26-31(29,30)16-12-5-2-6-13-16)17(19(27)24-21)14-8-7-11-15-9-3-1-4-10-15/h1-6,9-10,12-13,26H,7-8,11,14H2,(H,25,28)(H3,22,23,24,27)