N,N-diethyl-5-isothiocyanato-2-methoxy-benzamide

Systemtic Name: N,N-diethyl-5-isothiocyanato-2-methoxy-benzamide Openeye Name: N,N-diethyl-5-isothiocyanato-2-methoxy-benzamide CAS Name: N,N-diethyl-5-isothiocyanato-2-methoxybenzamide IUPAC Name: N,N-diethyl-5-isothiocyanato-2-methoxybenzamide Traditional Name: N,N-diethyl-5-isothiocyanato-2-methoxy-benzamide Formula: C13H16N2O2S MolecularWeight: 264.34334

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=C(C=CC(=C1)N=C=S)OC

Isomeric SMILES

CCN(CC)C(=O)C1=C(C=CC(=C1)N=C=S)OC

InChI

InChI=1S/C13H16N2O2S/c1-4-15(5-2)13(16)11-8-10(14-9-18)6-7-12(11)17-3/h6-8H,4-5H2,1-3H3