1-butyl-3-[4-[(6-methyl-5-phenyl-thieno[2,3-d]pyrimidin-4-yl)amino]phenyl]sulfonyl-urea

Systemtic Name: 1-butyl-3-[4-[(6-methyl-5-phenyl-thieno[2,3-d]pyrimidin-4-yl)amino]phenyl]sulfonyl-urea Openeye Name: 1-butyl-3-[4-[(6-methyl-5-phenyl-thieno[2,3-d]pyrimidin-4-yl)amino]phenyl]sulfonyl-urea CAS Name: 1-butyl-3-[4-[(6-methyl-5-phenyl-4-thieno[2,3-d]pyrimidinyl)amino]phenyl]sulfonylurea IUPAC Name: 1-butyl-3-[4-[(6-methyl-5-phenylthieno[2,3-d]pyrimidin-4-yl)amino]phenyl]sulfonylurea Traditional Name: 1-butyl-3-[4-[(6-methyl-5-phenyl-thieno[2,3-d]pyrimidin-4-yl)amino]phenyl]sulfonyl-urea Formula: C24H25N5O3S2 MolecularWeight: 495.617

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)NS(=O)(=O)C1=CC=C(C=C1)NC2=C3C(=C(SC3=NC=N2)C)C4=CC=CC=C4

Isomeric SMILES

CCCCNC(=O)NS(=O)(=O)C1=CC=C(C=C1)NC2=C3C(=C(SC3=NC=N2)C)C4=CC=CC=C4

InChI

InChI=1S/C24H25N5O3S2/c1-3-4-14-25-24(30)29-34(31,32)19-12-10-18(11-13-19)28-22-21-20(17-8-6-5-7-9-17)16(2)33-23(21)27-15-26-22/h5-13,15H,3-4,14H2,1-2H3,(H2,25,29,30)(H,26,27,28)