(5S)-N,N-dimethyl-5-piperidin-1-yl-5-sulfanylidene-11H-isoindolo[1,2-c][2,4,1]benzodiazaphosphinin-2-amine

Systemtic Name: (5S)-N,N-dimethyl-5-piperidin-1-yl-5-sulfanylidene-11H-isoindolo[1,2-c][2,4,1]benzodiazaphosphinin-2-amine Openeye Name: (5S)-N,N-dimethyl-5-(1-piperidyl)-5-thioxo-11H-isoindolo[1,2-c][2,4,1]benzodiazaphosphinin-2-amine CAS Name: (5S)-N,N-dimethyl-5-(1-piperidinyl)-5-sulfanylidene-11H-isoindolo[1,2-c][2,4,1]benzodiazaphosphorin-2-amine IUPAC Name: (5S)-N,N-dimethyl-5-piperidin-1-yl-5-sulfanylidene-11H-isoindolo[1,2-c][2,4,1]benzodiazaphosphinin-2-amine Traditional Name: dimethyl-[(5S)-5-piperidino-5-thioxo-11H-isoindolo[1,2-c][2,4,1]benzodiazaphosphorin-2-yl]amine Formula: C21H25N4PS MolecularWeight: 396.488761

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC2=C(C=C1)P(=S)(N=C3N2CC4=CC=CC=C43)N5CCCCC5

Isomeric SMILES

CN(C)C1=CC2=C(C=C1)[P@@](=S)(N=C3N2CC4=CC=CC=C43)N5CCCCC5

InChI

InChI=1S/C21H25N4PS/c1-23(2)17-10-11-20-19(14-17)25-15-16-8-4-5-9-18(16)21(25)22-26(20,27)24-12-6-3-7-13-24/h4-5,8-11,14H,3,6-7,12-13,15H2,1-2H3/t26-/m1/s1