2-cyano-N-[3-[[4-(4-methoxyphenyl)sulfanylpyrimidin-2-yl]amino]phenyl]ethanamide

Systemtic Name: 2-cyano-N-[3-[[4-(4-methoxyphenyl)sulfanylpyrimidin-2-yl]amino]phenyl]ethanamide Openeye Name: 2-cyano-N-[3-[[4-(4-methoxyphenyl)sulfanylpyrimidin-2-yl]amino]phenyl]acetamide CAS Name: 2-cyano-N-[3-[[4-[(4-methoxyphenyl)thio]-2-pyrimidinyl]amino]phenyl]acetamide IUPAC Name: 2-cyano-N-[3-[[4-(4-methoxyphenyl)sulfanylpyrimidin-2-yl]amino]phenyl]acetamide Traditional Name: 2-cyano-N-[3-[[4-[(4-methoxyphenyl)thio]pyrimidin-2-yl]amino]phenyl]acetamide Formula: C20H17N5O2S MolecularWeight: 391.44628

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)SC2=NC(=NC=C2)NC3=CC(=CC=C3)NC(=O)CC#N

Isomeric SMILES

COC1=CC=C(C=C1)SC2=NC(=NC=C2)NC3=CC(=CC=C3)NC(=O)CC#N

InChI

InChI=1S/C20H17N5O2S/c1-27-16-5-7-17(8-6-16)28-19-10-12-22-20(25-19)24-15-4-2-3-14(13-15)23-18(26)9-11-21/h2-8,10,12-13H,9H2,1H3,(H,23,26)(H,22,24,25)