4-(6-azanyl-2-methyl-4-oxidanylidene-1H-pyrimidin-5-yl)-N,N-bis(phenylmethyl)piperazine-1-sulfonamide

Systemtic Name: 4-(6-azanyl-2-methyl-4-oxidanylidene-1H-pyrimidin-5-yl)-N,N-bis(phenylmethyl)piperazine-1-sulfonamide Openeye Name: 4-(6-amino-2-methyl-4-oxo-1H-pyrimidin-5-yl)-N,N-dibenzyl-piperazine-1-sulfonamide CAS Name: 4-(6-amino-2-methyl-4-oxo-1H-pyrimidin-5-yl)-N,N-bis(phenylmethyl)-1-piperazinesulfonamide IUPAC Name: 4-(6-amino-2-methyl-4-oxo-1H-pyrimidin-5-yl)-N,N-dibenzylpiperazine-1-sulfonamide Traditional Name: 4-(6-amino-4-keto-2-methyl-1H-pyrimidin-5-yl)-N,N-dibenzyl-piperazine-1-sulfonamide Formula: C23H28N6O3S MolecularWeight: 468.57182

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=O)C(=C(N1)N)N2CCN(CC2)S(=O)(=O)N(CC3=CC=CC=C3)CC4=CC=CC=C4

Isomeric SMILES

CC1=NC(=O)C(=C(N1)N)N2CCN(CC2)S(=O)(=O)N(CC3=CC=CC=C3)CC4=CC=CC=C4

InChI

InChI=1S/C23H28N6O3S/c1-18-25-22(24)21(23(30)26-18)27-12-14-28(15-13-27)33(31,32)29(16-19-8-4-2-5-9-19)17-20-10-6-3-7-11-20/h2-11H,12-17H2,1H3,(H3,24,25,26,30)