methyl 2-(2-azanylethylsulfanyl)-3-cyano-naphthalene-1-carboxylate hydrochloride

Systemtic Name: methyl 2-(2-azanylethylsulfanyl)-3-cyano-naphthalene-1-carboxylate hydrochloride Openeye Name: methyl 2-(2-aminoethylsulfanyl)-3-cyano-naphthalene-1-carboxylate hydrochloride CAS Name: 2-(2-aminoethylthio)-3-cyano-1-naphthalenecarboxylic acid methyl ester hydrochloride IUPAC Name: methyl 2-(2-aminoethylsulfanyl)-3-cyanonaphthalene-1-carboxylate hydrochloride Traditional Name: 2-(2-aminoethylthio)-3-cyano-naphthalene-1-carboxylic acid methyl ester hydrochloride Formula: C15H15ClN2O2S MolecularWeight: 322.8098

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C(=CC2=CC=CC=C21)C#N)SCCN.Cl

Isomeric SMILES

COC(=O)C1=C(C(=CC2=CC=CC=C21)C#N)SCCN.Cl

InChI

InChI=1S/C15H14N2O2S.ClH/c1-19-15(18)13-12-5-3-2-4-10(12)8-11(9-17)14(13)20-7-6-16;/h2-5,8H,6-7,16H2,1H3;1H