4-[[5-azanyl-6-[(4-butylphenyl)amino]pyrimidin-4-yl]amino]-N,N-diethyl-benzenesulfonamide

Systemtic Name: 4-[[5-azanyl-6-[(4-butylphenyl)amino]pyrimidin-4-yl]amino]-N,N-diethyl-benzenesulfonamide Openeye Name: 4-[[5-amino-6-(4-butylanilino)pyrimidin-4-yl]amino]-N,N-diethyl-benzenesulfonamide CAS Name: 4-[[5-amino-6-(4-butylanilino)-4-pyrimidinyl]amino]-N,N-diethylbenzenesulfonamide IUPAC Name: 4-[[5-amino-6-(4-butylanilino)pyrimidin-4-yl]amino]-N,N-diethylbenzenesulfonamide Traditional Name: 4-[[5-amino-6-(4-butylanilino)pyrimidin-4-yl]amino]-N,N-diethyl-benzenesulfonamide Formula: C24H32N6O2S MolecularWeight: 468.61488

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC2=C(C(=NC=N2)NC3=CC=C(C=C3)S(=O)(=O)N(CC)CC)N

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC2=C(C(=NC=N2)NC3=CC=C(C=C3)S(=O)(=O)N(CC)CC)N

InChI

InChI=1S/C24H32N6O2S/c1-4-7-8-18-9-11-19(12-10-18)28-23-22(25)24(27-17-26-23)29-20-13-15-21(16-14-20)33(31,32)30(5-2)6-3/h9-17H,4-8,25H2,1-3H3,(H2,26,27,28,29)