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

Systemtic Name: N,N-dibutyl-2-chloranyl-5-methyl-6-sulfanylidene-9,13b-dihydro-8H-isoquinolino[2,1-c][1,3,2]benzodiazaphosphinin-6-amine Openeye Name: N,N-dibutyl-2-chloro-5-methyl-6-thioxo-9,13b-dihydro-8H-isoquinolino[2,1-c][1,3,2]benzodiazaphosphinin-6-amine CAS Name: N,N-dibutyl-2-chloro-5-methyl-6-sulfanylidene-9,13b-dihydro-8H-isoquinolino[2,1-c][1,3,2]benzodiazaphosphorin-6-amine IUPAC Name: N,N-dibutyl-2-chloro-5-methyl-6-sulfanylidene-9,13b-dihydro-8H-isoquinolino[2,1-c][1,3,2]benzodiazaphosphinin-6-amine Traditional Name: dibutyl-(2-chloro-5-methyl-6-thioxo-9,13b-dihydro-8H-isoquinolino[2,1-c][1,3,2]benzodiazaphosphorin-6-yl)amine Formula: C24H33ClN3PS MolecularWeight: 462.030681

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H33ClN3PS/c1-4-6-15-27(16-7-5-2)29(30)26(3)23-13-12-20(25)18-22(23)24-21-11-9-8-10-19(21)14-17-28(24)29/h8-13,18,24H,4-7,14-17H2,1-3H3