(3,4-diethoxyphenyl)-[4-[(4-phenyl-1,3-thiazol-2-yl)methyl]piperazin-1-yl]methanone

Systemtic Name: (3,4-diethoxyphenyl)-[4-[(4-phenyl-1,3-thiazol-2-yl)methyl]piperazin-1-yl]methanone Openeye Name: (3,4-diethoxyphenyl)-[4-[(4-phenylthiazol-2-yl)methyl]piperazin-1-yl]methanone CAS Name: (3,4-diethoxyphenyl)-[4-[(4-phenyl-2-thiazolyl)methyl]-1-piperazinyl]methanone IUPAC Name: (3,4-diethoxyphenyl)-[4-[(4-phenyl-1,3-thiazol-2-yl)methyl]piperazin-1-yl]methanone Traditional Name: (3,4-diethoxyphenyl)-[4-[(4-phenylthiazol-2-yl)methyl]piperazino]methanone Formula: C25H29N3O3S MolecularWeight: 451.58106

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)N2CCN(CC2)CC3=NC(=CS3)C4=CC=CC=C4)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)N2CCN(CC2)CC3=NC(=CS3)C4=CC=CC=C4)OCC

InChI

InChI=1S/C25H29N3O3S/c1-3-30-22-11-10-20(16-23(22)31-4-2)25(29)28-14-12-27(13-15-28)17-24-26-21(18-32-24)19-8-6-5-7-9-19/h5-11,16,18H,3-4,12-15,17H2,1-2H3