[4-(2-diethylaminoethylcarbamoyl)phenyl] thiocyanate hydrochloride

Systemtic Name: [4-(2-diethylaminoethylcarbamoyl)phenyl] thiocyanate hydrochloride Openeye Name: [4-(2-diethylaminoethylcarbamoyl)phenyl] thiocyanate hydrochloride CAS Name: thiocyanic acid [4-[(2-diethylaminoethylamino)-oxomethyl]phenyl] ester hydrochloride IUPAC Name: [4-(2-diethylaminoethylcarbamoyl)phenyl] thiocyanate hydrochloride Traditional Name: thiocyanic acid [4-(2-diethylaminoethylcarbamoyl)phenyl] ester hydrochloride Formula: C14H20ClN3OS MolecularWeight: 313.8461

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCNC(=O)C1=CC=C(C=C1)SC#N.Cl

Isomeric SMILES

CCN(CC)CCNC(=O)C1=CC=C(C=C1)SC#N.Cl

InChI

InChI=1S/C14H19N3OS.ClH/c1-3-17(4-2)10-9-16-14(18)12-5-7-13(8-6-12)19-11-15;/h5-8H,3-4,9-10H2,1-2H3,(H,16,18);1H