4-[2,1,3-benzothiadiazol-4-yl-(4,4-diethylcyclohexa-2,5-dien-1-ylidene)methyl]-N,N-diethyl-aniline

Systemtic Name: 4-[2,1,3-benzothiadiazol-4-yl-(4,4-diethylcyclohexa-2,5-dien-1-ylidene)methyl]-N,N-diethyl-aniline Openeye Name: 4-[2,1,3-benzothiadiazol-4-yl-(4,4-diethylcyclohexa-2,5-dien-1-ylidene)methyl]-N,N-diethyl-aniline CAS Name: 4-[2,1,3-benzothiadiazol-4-yl-(4,4-diethyl-1-cyclohexa-2,5-dienylidene)methyl]-N,N-diethylaniline IUPAC Name: 4-[2,1,3-benzothiadiazol-4-yl-(4,4-diethylcyclohexa-2,5-dien-1-ylidene)methyl]-N,N-diethylaniline Traditional Name: [4-[(4,4-diethylcyclohexa-2,5-dien-1-ylidene)-piazthiol-4-yl-methyl]phenyl]-diethyl-amine Formula: C27H31N3S MolecularWeight: 429.62014

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(C=CC(=C(C2=CC=C(C=C2)N(CC)CC)C3=CC=CC4=NSN=C43)C=C1)CC

Isomeric SMILES

CCC1(C=CC(=C(C2=CC=C(C=C2)N(CC)CC)C3=CC=CC4=NSN=C43)C=C1)CC

InChI

InChI=1S/C27H31N3S/c1-5-27(6-2)18-16-21(17-19-27)25(23-10-9-11-24-26(23)29-31-28-24)20-12-14-22(15-13-20)30(7-3)8-4/h9-19H,5-8H2,1-4H3