N-(2-ethylphenyl)-N-[4-[(prop-2-ynylcarbamothioylamino)methyl]-1,3-thiazol-2-yl]ethanamide

Systemtic Name: N-(2-ethylphenyl)-N-[4-[(prop-2-ynylcarbamothioylamino)methyl]-1,3-thiazol-2-yl]ethanamide Openeye Name: N-(2-ethylphenyl)-N-[4-[(prop-2-ynylcarbamothioylamino)methyl]thiazol-2-yl]acetamide CAS Name: N-(2-ethylphenyl)-N-[4-[[[(prop-2-ynylamino)-sulfanylidenemethyl]amino]methyl]-2-thiazolyl]acetamide IUPAC Name: N-(2-ethylphenyl)-N-[4-[(prop-2-ynylcarbamothioylamino)methyl]-1,3-thiazol-2-yl]acetamide Traditional Name: N-(2-ethylphenyl)-N-[4-[(propargylthiocarbamoylamino)methyl]thiazol-2-yl]acetamide Formula: C18H20N4OS2 MolecularWeight: 372.5076

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1N(C2=NC(=CS2)CNC(=S)NCC#C)C(=O)C

Isomeric SMILES

CCC1=CC=CC=C1N(C2=NC(=CS2)CNC(=S)NCC#C)C(=O)C

InChI

InChI=1S/C18H20N4OS2/c1-4-10-19-17(24)20-11-15-12-25-18(21-15)22(13(3)23)16-9-7-6-8-14(16)5-2/h1,6-9,12H,5,10-11H2,2-3H3,(H2,19,20,24)