4-(7,8-dimethyl-1,5-dihydro-2,4-benzodithiepin-3-yl)-N,N-diethyl-aniline

Systemtic Name: 4-(7,8-dimethyl-1,5-dihydro-2,4-benzodithiepin-3-yl)-N,N-diethyl-aniline Openeye Name: 4-(7,8-dimethyl-1,5-dihydro-2,4-benzodithiepin-3-yl)-N,N-diethyl-aniline CAS Name: 4-(7,8-dimethyl-1,5-dihydro-2,4-benzodithiepin-3-yl)-N,N-diethylaniline IUPAC Name: 4-(7,8-dimethyl-1,5-dihydro-2,4-benzodithiepin-3-yl)-N,N-diethylaniline Traditional Name: [4-(7,8-dimethyl-1,5-dihydro-2,4-benzodithiepin-3-yl)phenyl]-diethyl-amine Formula: C21H27NS2 MolecularWeight: 357.57578

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC=C(C=C1)C2SCC3=CC(=C(C=C3CS2)C)C

Isomeric SMILES

CCN(CC)C1=CC=C(C=C1)C2SCC3=CC(=C(C=C3CS2)C)C

InChI

InChI=1S/C21H27NS2/c1-5-22(6-2)20-9-7-17(8-10-20)21-23-13-18-11-15(3)16(4)12-19(18)14-24-21/h7-12,21H,5-6,13-14H2,1-4H3