N-[4-[[4-[(4-methoxyphenyl)amino]-6-methyl-pyrimidin-2-yl]amino]phenyl]thiophene-2-carboxamide

Systemtic Name: N-[4-[[4-[(4-methoxyphenyl)amino]-6-methyl-pyrimidin-2-yl]amino]phenyl]thiophene-2-carboxamide Openeye Name: N-[4-[[4-(4-methoxyanilino)-6-methyl-pyrimidin-2-yl]amino]phenyl]thiophene-2-carboxamide CAS Name: N-[4-[[4-(4-methoxyanilino)-6-methyl-2-pyrimidinyl]amino]phenyl]-2-thiophenecarboxamide IUPAC Name: N-[4-[[4-(4-methoxyanilino)-6-methylpyrimidin-2-yl]amino]phenyl]thiophene-2-carboxamide Traditional Name: N-[4-[[4-methyl-6-(p-anisidino)pyrimidin-2-yl]amino]phenyl]thiophene-2-carboxamide Formula: C23H21N5O2S MolecularWeight: 431.51014

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)NC2=CC=C(C=C2)NC(=O)C3=CC=CS3)NC4=CC=C(C=C4)OC

Isomeric SMILES

CC1=CC(=NC(=N1)NC2=CC=C(C=C2)NC(=O)C3=CC=CS3)NC4=CC=C(C=C4)OC

InChI

InChI=1S/C23H21N5O2S/c1-15-14-21(25-16-9-11-19(30-2)12-10-16)28-23(24-15)27-18-7-5-17(6-8-18)26-22(29)20-4-3-13-31-20/h3-14H,1-2H3,(H,26,29)(H2,24,25,27,28)