[(E)-(5,7-diethyl-4a,9a-dihydrothioxanthen-9-ylidene)amino] benzoate

Systemtic Name: [(E)-(5,7-diethyl-4a,9a-dihydrothioxanthen-9-ylidene)amino] benzoate Openeye Name: [(E)-(5,7-diethyl-4a,9a-dihydrothioxanthen-9-ylidene)amino] benzoate CAS Name: benzoic acid [(E)-(5,7-diethyl-4a,9a-dihydrothioxanthen-9-ylidene)amino] ester IUPAC Name: [(E)-(5,7-diethyl-4a,9a-dihydrothioxanthen-9-ylidene)amino] benzoate Traditional Name: benzoic acid [(E)-(5,7-diethyl-4a,9a-dihydrothioxanthen-9-ylidene)amino] ester Formula: C24H23NO2S MolecularWeight: 389.50992

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C2C(=C1)C(=NOC(=O)C3=CC=CC=C3)C4C=CC=CC4S2)CC

Isomeric SMILES

CCC1=CC(=C2C(=C1)/C(=N/OC(=O)C3=CC=CC=C3)/C4C=CC=CC4S2)CC

InChI

InChI=1S/C24H23NO2S/c1-3-16-14-17(4-2)23-20(15-16)22(19-12-8-9-13-21(19)28-23)25-27-24(26)18-10-6-5-7-11-18/h5-15,19,21H,3-4H2,1-2H3/b25-22+