(Z)-but-2-enedioic acid; (3Z)-3-(6-fluoranyl-2-propan-2-yl-thioxanthen-9-ylidene)-N,N-dimethyl-propan-1-amine

Systemtic Name: (Z)-but-2-enedioic acid; (3Z)-3-(6-fluoranyl-2-propan-2-yl-thioxanthen-9-ylidene)-N,N-dimethyl-propan-1-amine Openeye Name: (3Z)-3-(6-fluoro-2-isopropyl-thioxanthen-9-ylidene)-N,N-dimethyl-propan-1-amine; maleic acid CAS Name: (Z)-2-butenedioic acid; (3Z)-3-(6-fluoro-2-propan-2-yl-9-thioxanthenylidene)-N,N-dimethyl-1-propanamine IUPAC Name: (Z)-but-2-enedioic acid; (3Z)-3-(6-fluoro-2-propan-2-ylthioxanthen-9-ylidene)-N,N-dimethylpropan-1-amine Traditional Name: [(3Z)-3-(6-fluoro-2-isopropyl-thioxanthen-9-ylidene)propyl]-dimethyl-amine; maleic acid Formula: C25H28FNO4S MolecularWeight: 457.557523

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC2=C(C=C1)SC3=C(C2=CCCN(C)C)C=CC(=C3)F.C(=CC(=O)O)C(=O)O

Isomeric SMILES

CC(C)C1=CC\2=C(C=C1)SC3=C(/C2=C/CCN(C)C)C=CC(=C3)F.C(=C\C(=O)O)\C(=O)O

InChI

InChI=1S/C21H24FNS.C4H4O4/c1-14(2)15-7-10-20-19(12-15)17(6-5-11-23(3)4)18-9-8-16(22)13-21(18)24-20;5-3(6)1-2-4(7)8/h6-10,12-14H,5,11H2,1-4H3;1-2H,(H,5,6)(H,7,8)/b17-6-;2-1-