N-(2-cyanoethyl)-N-[ethylamino(propylsulfanyl)phosphoryl]benzenesulfonamide

Systemtic Name: N-(2-cyanoethyl)-N-[ethylamino(propylsulfanyl)phosphoryl]benzenesulfonamide Openeye Name: N-(2-cyanoethyl)-N-[ethylamino(propylsulfanyl)phosphoryl]benzenesulfonamide CAS Name: N-(2-cyanoethyl)-N-[ethylamino-(propylthio)phosphoryl]benzenesulfonamide IUPAC Name: N-(2-cyanoethyl)-N-[ethylamino(propylsulfanyl)phosphoryl]benzenesulfonamide Traditional Name: N-(2-cyanoethyl)-N-[ethylamino-(propylthio)phosphoryl]benzenesulfonamide Formula: C14H22N3O3PS2 MolecularWeight: 375.446541

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Descriptors Computed from Structure

Canonical SMILES:

CCCSP(=O)(NCC)N(CCC#N)S(=O)(=O)C1=CC=CC=C1

Isomeric SMILES

CCCSP(=O)(NCC)N(CCC#N)S(=O)(=O)C1=CC=CC=C1

InChI

InChI=1S/C14H22N3O3PS2/c1-3-13-22-21(18,16-4-2)17(12-8-11-15)23(19,20)14-9-6-5-7-10-14/h5-7,9-10H,3-4,8,12-13H2,1-2H3,(H,16,18)