2-[(4-methoxyphenyl)methylcarbamothioylamino]-N-(1,3,5-trimethylpyrazol-4-yl)ethanamide

Systemtic Name: 2-[(4-methoxyphenyl)methylcarbamothioylamino]-N-(1,3,5-trimethylpyrazol-4-yl)ethanamide Openeye Name: 2-[(4-methoxyphenyl)methylcarbamothioylamino]-N-(1,3,5-trimethylpyrazol-4-yl)acetamide CAS Name: 2-[[[(4-methoxyphenyl)methylamino]-sulfanylidenemethyl]amino]-N-(1,3,5-trimethyl-4-pyrazolyl)acetamide IUPAC Name: 2-[(4-methoxyphenyl)methylcarbamothioylamino]-N-(1,3,5-trimethylpyrazol-4-yl)acetamide Traditional Name: 2-(p-anisylthiocarbamoylamino)-N-(1,3,5-trimethylpyrazol-4-yl)acetamide Formula: C17H23N5O2S MolecularWeight: 361.46182

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C)NC(=O)CNC(=S)NCC2=CC=C(C=C2)OC

Isomeric SMILES

CC1=C(C(=NN1C)C)NC(=O)CNC(=S)NCC2=CC=C(C=C2)OC

InChI

InChI=1S/C17H23N5O2S/c1-11-16(12(2)22(3)21-11)20-15(23)10-19-17(25)18-9-13-5-7-14(24-4)8-6-13/h5-8H,9-10H2,1-4H3,(H,20,23)(H2,18,19,25)