(3,4-diethoxyphenyl)-[4-(2-fluorophenyl)piperazin-1-yl]methanethione

Systemtic Name: (3,4-diethoxyphenyl)-[4-(2-fluorophenyl)piperazin-1-yl]methanethione Openeye Name: (3,4-diethoxyphenyl)-[4-(2-fluorophenyl)piperazin-1-yl]methanethione CAS Name: (3,4-diethoxyphenyl)-[4-(2-fluorophenyl)-1-piperazinyl]methanethione IUPAC Name: (3,4-diethoxyphenyl)-[4-(2-fluorophenyl)piperazin-1-yl]methanethione Traditional Name: (3,4-diethoxyphenyl)-[4-(2-fluorophenyl)piperazino]methanethione Formula: C21H25FN2O2S MolecularWeight: 388.498803

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=S)N2CCN(CC2)C3=CC=CC=C3F)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=S)N2CCN(CC2)C3=CC=CC=C3F)OCC

InChI

InChI=1S/C21H25FN2O2S/c1-3-25-19-10-9-16(15-20(19)26-4-2)21(27)24-13-11-23(12-14-24)18-8-6-5-7-17(18)22/h5-10,15H,3-4,11-14H2,1-2H3