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

Systemtic Name: N-[4-[2-[4-(methylcarbamothioylamino)phenyl]ethyl]pyrimidin-2-yl]ethanamide Openeye Name: N-[4-[2-[4-(methylcarbamothioylamino)phenyl]ethyl]pyrimidin-2-yl]acetamide CAS Name: N-[4-[2-[4-[[methylamino(sulfanylidene)methyl]amino]phenyl]ethyl]-2-pyrimidinyl]acetamide IUPAC Name: N-[4-[2-[4-(methylcarbamothioylamino)phenyl]ethyl]pyrimidin-2-yl]acetamide Traditional Name: N-[4-[2-[4-(methylthiocarbamoylamino)phenyl]ethyl]pyrimidin-2-yl]acetamide Formula: C16H19N5OS MolecularWeight: 329.41996

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H19N5OS/c1-11(22)19-15-18-10-9-14(20-15)8-5-12-3-6-13(7-4-12)21-16(23)17-2/h3-4,6-7,9-10H,5,8H2,1-2H3,(H2,17,21,23)(H,18,19,20,22)