N-tert-butyl-3-[5-[5-methyl-2-[[4-(4-methylpiperazin-1-yl)phenyl]amino]pyrimidin-4-yl]thiophen-2-yl]benzenesulfonamide

Systemtic Name: N-tert-butyl-3-[5-[5-methyl-2-[[4-(4-methylpiperazin-1-yl)phenyl]amino]pyrimidin-4-yl]thiophen-2-yl]benzenesulfonamide Openeye Name: N-tert-butyl-3-[5-[5-methyl-2-[4-(4-methylpiperazin-1-yl)anilino]pyrimidin-4-yl]-2-thienyl]benzenesulfonamide CAS Name: N-tert-butyl-3-[5-[5-methyl-2-[4-(4-methyl-1-piperazinyl)anilino]-4-pyrimidinyl]-2-thiophenyl]benzenesulfonamide IUPAC Name: N-tert-butyl-3-[5-[5-methyl-2-[4-(4-methylpiperazin-1-yl)anilino]pyrimidin-4-yl]thiophen-2-yl]benzenesulfonamide Traditional Name: N-tert-butyl-3-[5-[5-methyl-2-[4-(4-methylpiperazino)anilino]pyrimidin-4-yl]-2-thienyl]benzenesulfonamide Formula: C30H36N6O2S2 MolecularWeight: 576.77584

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(N=C1C2=CC=C(S2)C3=CC(=CC=C3)S(=O)(=O)NC(C)(C)C)NC4=CC=C(C=C4)N5CCN(CC5)C

Isomeric SMILES

CC1=CN=C(N=C1C2=CC=C(S2)C3=CC(=CC=C3)S(=O)(=O)NC(C)(C)C)NC4=CC=C(C=C4)N5CCN(CC5)C

InChI

InChI=1S/C30H36N6O2S2/c1-21-20-31-29(32-23-9-11-24(12-10-23)36-17-15-35(5)16-18-36)33-28(21)27-14-13-26(39-27)22-7-6-8-25(19-22)40(37,38)34-30(2,3)4/h6-14,19-20,34H,15-18H2,1-5H3,(H,31,32,33)