5-[2-[(4-methoxyphenyl)amino]pyrimidin-4-yl]-N-phenethyl-thiophene-2-carboxamide

Systemtic Name: 5-[2-[(4-methoxyphenyl)amino]pyrimidin-4-yl]-N-phenethyl-thiophene-2-carboxamide Openeye Name: 5-[2-(4-methoxyanilino)pyrimidin-4-yl]-N-phenethyl-thiophene-2-carboxamide CAS Name: 5-[2-(4-methoxyanilino)-4-pyrimidinyl]-N-phenethyl-2-thiophenecarboxamide IUPAC Name: 5-[2-(4-methoxyanilino)pyrimidin-4-yl]-N-phenethylthiophene-2-carboxamide Traditional Name: 5-[2-(p-anisidino)pyrimidin-4-yl]-N-phenethyl-thiophene-2-carboxamide Formula: C24H22N4O2S MolecularWeight: 430.52208

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC2=NC=CC(=N2)C3=CC=C(S3)C(=O)NCCC4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)NC2=NC=CC(=N2)C3=CC=C(S3)C(=O)NCCC4=CC=CC=C4

InChI

InChI=1S/C24H22N4O2S/c1-30-19-9-7-18(8-10-19)27-24-26-16-14-20(28-24)21-11-12-22(31-21)23(29)25-15-13-17-5-3-2-4-6-17/h2-12,14,16H,13,15H2,1H3,(H,25,29)(H,26,27,28)