N-[1-(2-azanyl-2-sulfanylidene-ethyl)pyrazol-3-yl]-4-(methoxymethyl)benzamide

Systemtic Name: N-[1-(2-azanyl-2-sulfanylidene-ethyl)pyrazol-3-yl]-4-(methoxymethyl)benzamide Openeye Name: N-[1-(2-amino-2-thioxo-ethyl)pyrazol-3-yl]-4-(methoxymethyl)benzamide CAS Name: N-[1-(2-amino-2-sulfanylideneethyl)-3-pyrazolyl]-4-(methoxymethyl)benzamide IUPAC Name: N-[1-(2-amino-2-sulfanylideneethyl)pyrazol-3-yl]-4-(methoxymethyl)benzamide Traditional Name: N-[1-(2-amino-2-thioxo-ethyl)pyrazol-3-yl]-4-(methoxymethyl)benzamide Formula: C14H16N4O2S MolecularWeight: 304.36744

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Descriptors Computed from Structure

Canonical SMILES:

COCC1=CC=C(C=C1)C(=O)NC2=NN(C=C2)CC(=S)N

Isomeric SMILES

COCC1=CC=C(C=C1)C(=O)NC2=NN(C=C2)CC(=S)N

InChI

InChI=1S/C14H16N4O2S/c1-20-9-10-2-4-11(5-3-10)14(19)16-13-6-7-18(17-13)8-12(15)21/h2-7H,8-9H2,1H3,(H2,15,21)(H,16,17,19)