N-[4-[2-[4-(methylsulfanylcarbamoylamino)phenyl]ethyl]pyrimidin-2-yl]ethanamide

Systemtic Name: N-[4-[2-[4-(methylsulfanylcarbamoylamino)phenyl]ethyl]pyrimidin-2-yl]ethanamide Openeye Name: N-[4-[2-[4-(methylsulfanylcarbamoylamino)phenyl]ethyl]pyrimidin-2-yl]acetamide CAS Name: N-[4-[2-[4-[[[(methylthio)amino]-oxomethyl]amino]phenyl]ethyl]-2-pyrimidinyl]acetamide IUPAC Name: N-[4-[2-[4-(methylsulfanylcarbamoylamino)phenyl]ethyl]pyrimidin-2-yl]acetamide Traditional Name: N-[4-[2-[4-[(methylthio)carbamoylamino]phenyl]ethyl]pyrimidin-2-yl]acetamide Formula: C16H19N5O2S MolecularWeight: 345.41936

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=NC=CC(=N1)CCC2=CC=C(C=C2)NC(=O)NSC

Isomeric SMILES

CC(=O)NC1=NC=CC(=N1)CCC2=CC=C(C=C2)NC(=O)NSC

InChI

InChI=1S/C16H19N5O2S/c1-11(22)18-15-17-10-9-14(19-15)8-5-12-3-6-13(7-4-12)20-16(23)21-24-2/h3-4,6-7,9-10H,5,8H2,1-2H3,(H2,20,21,23)(H,17,18,19,22)