N-[1,1-bis(oxidanylidene)-3,4-dihydro-2H-thiochromen-4-yl]-N',N'-diethyl-propane-1,3-diamine

Systemtic Name: N-[1,1-bis(oxidanylidene)-3,4-dihydro-2H-thiochromen-4-yl]-N',N'-diethyl-propane-1,3-diamine Openeye Name: N-(1,1-dioxo-3,4-dihydro-2H-thiochromen-4-yl)-N',N'-diethyl-propane-1,3-diamine CAS Name: N-(1,1-dioxo-3,4-dihydro-2H-1-benzothiopyran-4-yl)-N',N'-diethylpropane-1,3-diamine IUPAC Name: N-(1,1-dioxo-3,4-dihydro-2H-thiochromen-4-yl)-N',N'-diethylpropane-1,3-diamine Traditional Name: 3-[(1,1-diketo-3,4-dihydro-2H-thiochromen-4-yl)amino]propyl-diethyl-amine Formula: C16H26N2O2S MolecularWeight: 310.45484

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCCNC1CCS(=O)(=O)C2=CC=CC=C12

Isomeric SMILES

CCN(CC)CCCNC1CCS(=O)(=O)C2=CC=CC=C12

InChI

InChI=1S/C16H26N2O2S/c1-3-18(4-2)12-7-11-17-15-10-13-21(19,20)16-9-6-5-8-14(15)16/h5-6,8-9,15,17H,3-4,7,10-13H2,1-2H3