4-[(7-chloranyl-2-heptadecyl-pyrazolo[1,5-a]benzimidazol-3-ylidene)amino]-N,N-diethyl-aniline

Systemtic Name: 4-[(7-chloranyl-2-heptadecyl-pyrazolo[1,5-a]benzimidazol-3-ylidene)amino]-N,N-diethyl-aniline Openeye Name: 4-[(7-chloro-2-heptadecyl-pyrazolo[1,5-a]benzimidazol-3-ylidene)amino]-N,N-diethyl-aniline CAS Name: 4-[(7-chloro-2-heptadecyl-3-pyrazolo[1,5-a]benzimidazolylidene)amino]-N,N-diethylaniline IUPAC Name: 4-[(7-chloro-2-heptadecylpyrazolo[1,5-a]benzimidazol-3-ylidene)amino]-N,N-diethylaniline Traditional Name: [4-[(7-chloro-2-heptadecyl-pyrazolo[1,5-a]benzimidazol-3-ylidene)amino]phenyl]-diethyl-amine Formula: C36H52ClN5 MolecularWeight: 590.28458

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC1=NN2C3=C(C=CC(=C3)Cl)N=C2C1=NC4=CC=C(C=C4)N(CC)CC

Isomeric SMILES

CCCCCCCCCCCCCCCCCC1=NN2C3=C(C=CC(=C3)Cl)N=C2C1=NC4=CC=C(C=C4)N(CC)CC

InChI

InChI=1S/C36H52ClN5/c1-4-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-33-35(38-30-23-25-31(26-24-30)41(5-2)6-3)36-39-32-27-22-29(37)28-34(32)42(36)40-33/h22-28H,4-21H2,1-3H3