2-(2-naphthalen-2-ylsulfanylethanoylamino)-N-(1,3,5-trimethylpyrazol-4-yl)ethanamide

Systemtic Name: 2-(2-naphthalen-2-ylsulfanylethanoylamino)-N-(1,3,5-trimethylpyrazol-4-yl)ethanamide Openeye Name: 2-[[2-(2-naphthylsulfanyl)acetyl]amino]-N-(1,3,5-trimethylpyrazol-4-yl)acetamide CAS Name: 2-[[2-(2-naphthalenylthio)-1-oxoethyl]amino]-N-(1,3,5-trimethyl-4-pyrazolyl)acetamide IUPAC Name: 2-[(2-naphthalen-2-ylsulfanylacetyl)amino]-N-(1,3,5-trimethylpyrazol-4-yl)acetamide Traditional Name: 2-[[2-(2-naphthylthio)acetyl]amino]-N-(1,3,5-trimethylpyrazol-4-yl)acetamide Formula: C20H22N4O2S MolecularWeight: 382.47928

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C)NC(=O)CNC(=O)CSC2=CC3=CC=CC=C3C=C2

Isomeric SMILES

CC1=C(C(=NN1C)C)NC(=O)CNC(=O)CSC2=CC3=CC=CC=C3C=C2

InChI

InChI=1S/C20H22N4O2S/c1-13-20(14(2)24(3)23-13)22-18(25)11-21-19(26)12-27-17-9-8-15-6-4-5-7-16(15)10-17/h4-10H,11-12H2,1-3H3,(H,21,26)(H,22,25)