2-chloranyl-N,N-diethyl-5-methyl-6-sulfanylidene-9,13b-dihydro-8H-isoquinolino[2,1-c][1,3,2]benzodiazaphosphinin-6-amine

Systemtic Name: 2-chloranyl-N,N-diethyl-5-methyl-6-sulfanylidene-9,13b-dihydro-8H-isoquinolino[2,1-c][1,3,2]benzodiazaphosphinin-6-amine Openeye Name: 2-chloro-N,N-diethyl-5-methyl-6-thioxo-9,13b-dihydro-8H-isoquinolino[2,1-c][1,3,2]benzodiazaphosphinin-6-amine CAS Name: 2-chloro-N,N-diethyl-5-methyl-6-sulfanylidene-9,13b-dihydro-8H-isoquinolino[2,1-c][1,3,2]benzodiazaphosphorin-6-amine IUPAC Name: 2-chloro-N,N-diethyl-5-methyl-6-sulfanylidene-9,13b-dihydro-8H-isoquinolino[2,1-c][1,3,2]benzodiazaphosphinin-6-amine Traditional Name: (2-chloro-5-methyl-6-thioxo-9,13b-dihydro-8H-isoquinolino[2,1-c][1,3,2]benzodiazaphosphorin-6-yl)-diethyl-amine Formula: C20H25ClN3PS MolecularWeight: 405.924361

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)P1(=S)N(C2=C(C=C(C=C2)Cl)C3N1CCC4=CC=CC=C34)C

Isomeric SMILES

CCN(CC)P1(=S)N(C2=C(C=C(C=C2)Cl)C3N1CCC4=CC=CC=C34)C

InChI

InChI=1S/C20H25ClN3PS/c1-4-23(5-2)25(26)22(3)19-11-10-16(21)14-18(19)20-17-9-7-6-8-15(17)12-13-24(20)25/h6-11,14,20H,4-5,12-13H2,1-3H3