1-diphenylphosphoryl-2-phenylsulfanyl-prop-2-en-1-amine hydrochloride

Systemtic Name: 1-diphenylphosphoryl-2-phenylsulfanyl-prop-2-en-1-amine hydrochloride Openeye Name: 1-diphenylphosphoryl-2-phenylsulfanyl-prop-2-en-1-amine hydrochloride CAS Name: 1-diphenylphosphoryl-2-(phenylthio)-2-propen-1-amine hydrochloride IUPAC Name: 1-diphenylphosphoryl-2-phenylsulfanylprop-2-en-1-amine hydrochloride Traditional Name: [1-diphenylphosphoryl-2-(phenylthio)allyl]amine hydrochloride Formula: C21H21ClNOPS MolecularWeight: 401.889301

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Descriptors Computed from Structure

Canonical SMILES:

C=C(C(N)P(=O)(C1=CC=CC=C1)C2=CC=CC=C2)SC3=CC=CC=C3.Cl

Isomeric SMILES

C=C(C(N)P(=O)(C1=CC=CC=C1)C2=CC=CC=C2)SC3=CC=CC=C3.Cl

InChI

InChI=1S/C21H20NOPS.ClH/c1-17(25-20-15-9-4-10-16-20)21(22)24(23,18-11-5-2-6-12-18)19-13-7-3-8-14-19;/h2-16,21H,1,22H2;1H